butyl 4-aminobenzoate

Synonyms: "butamben", "Butesin", "Butylcaine", "Butyl aminobenzoate", "Butoform", "Butesine", "Scuroform", "Planoform", "Scuroforme", "Butyl keloform", "butyl-p-aminobenzoate", "4-(butoxycarbonyl)aniline", "N-butyl p-aminobenzoate", "4-aminobenzoic acid n-butyl ester", "n-butyl-p-aminobenzoate", "4-aminobenzoic acid butyl ester", "p-aminobenzoic acid butyl ester", "butsein", "butyl PABA", "4-amino butylbenzoate".

Source: butyl 4-aminobenzoate is a local anesthetic used in topical preparationsis used as pharmaceutical intermediate.

Identifiers:

IUPAC Name: butyl 4-aminobenzoate
CAS Number: 94-25-7
PubChem ID: 2482
InChiKey: IUWVALYLNVXWKX-UHFFFAOYSA-N
Canonical SMILES: CCCCOC(=O)C1=CC=C(C=C1)N

Structural Properties:

Molecular Formula: C11H15NO2
Molecular Weight: 193.246

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 3
Number of atoms different from hydrogen: 14

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Fang H, Tong WD, Branham WS, Moland CL, Dial SL, Hong HX, Xie Q, Perkins R, Owens W, Sheehan DM. 2003. Study of 202 natural, synthetic, and environmental chemicals for binding to the androgen receptor. Chem Res Toxicol 16(10):1338-1358. DOI: 10.1021/tx030011g. URL: http://pubs.acs.org/doi/abs/10.1021/tx030011g.

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