propan-2-yl 4-(4-aminophenyl)-4-oxidanylidene-butanoate hydrochloride

Systemtic Name: propan-2-yl 4-(4-aminophenyl)-4-oxidanylidene-butanoate hydrochloride Openeye Name: isopropyl 4-(4-aminophenyl)-4-oxo-butanoate hydrochloride CAS Name: 4-(4-aminophenyl)-4-oxobutanoic acid propan-2-yl ester hydrochloride IUPAC Name: propan-2-yl 4-(4-aminophenyl)-4-oxobutanoate hydrochloride Traditional Name: 4-(4-aminophenyl)-4-keto-butyric acid isopropyl ester hydrochloride Formula: C13H18ClNO3 MolecularWeight: 271.73992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCC(=O)C1=CC=C(C=C1)N.Cl

Isomeric SMILES

CC(C)OC(=O)CCC(=O)C1=CC=C(C=C1)N.Cl

InChI

InChI=1S/C13H17NO3.ClH/c1-9(2)17-13(16)8-7-12(15)10-3-5-11(14)6-4-10;/h3-6,9H,7-8,14H2,1-2H3;1H