ethyl (3S)-1-[3-[(3-methoxyphenyl)amino]-3-oxidanylidene-propyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[3-[(3-methoxyphenyl)amino]-3-oxidanylidene-propyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[3-(3-methoxyanilino)-3-oxo-propyl]piperidine-3-carboxylate CAS Name: (3S)-1-[3-(3-methoxyanilino)-3-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[3-(3-methoxyanilino)-3-oxopropyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[3-keto-3-(m-anisidino)propyl]nipecotic acid ethyl ester Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CCC(=O)NC2=CC(=CC=C2)OC

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)CCC(=O)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C18H26N2O4/c1-3-24-18(22)14-6-5-10-20(13-14)11-9-17(21)19-15-7-4-8-16(12-15)23-2/h4,7-8,12,14H,3,5-6,9-11,13H2,1-2H3,(H,19,21)/t14-/m0/s1