ethyl 1-[3-[(3-bromophenyl)amino]-3-oxidanylidene-propyl]-4-phenyl-piperidine-4-carboxylate hydrochloride

Systemtic Name: ethyl 1-[3-[(3-bromophenyl)amino]-3-oxidanylidene-propyl]-4-phenyl-piperidine-4-carboxylate hydrochloride Openeye Name: ethyl 1-[3-(3-bromoanilino)-3-oxo-propyl]-4-phenyl-piperidine-4-carboxylate hydrochloride CAS Name: 1-[3-(3-bromoanilino)-3-oxopropyl]-4-phenyl-4-piperidinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 1-[3-(3-bromoanilino)-3-oxopropyl]-4-phenylpiperidine-4-carboxylate hydrochloride Traditional Name: 1-[3-(3-bromoanilino)-3-keto-propyl]-4-phenyl-isonipecotic acid ethyl ester hydrochloride Formula: C23H28BrClN2O3 MolecularWeight: 495.83702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CCC(=O)NC2=CC(=CC=C2)Br)C3=CC=CC=C3.Cl

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CCC(=O)NC2=CC(=CC=C2)Br)C3=CC=CC=C3.Cl

InChI

InChI=1S/C23H27BrN2O3.ClH/c1-2-29-22(28)23(18-7-4-3-5-8-18)12-15-26(16-13-23)14-11-21(27)25-20-10-6-9-19(24)17-20;/h3-10,17H,2,11-16H2,1H3,(H,25,27);1H