ethyl (3S)-1-[2-[[3-(methylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[2-[[3-(methylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[2-[3-(methylcarbamoyl)anilino]-2-oxo-ethyl]piperidine-3-carboxylate CAS Name: (3S)-1-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[2-keto-2-[3-(methylcarbamoyl)anilino]ethyl]nipecotic acid ethyl ester Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(=O)NC2=CC=CC(=C2)C(=O)NC

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O4/c1-3-25-18(24)14-7-5-9-21(11-14)12-16(22)20-15-8-4-6-13(10-15)17(23)19-2/h4,6,8,10,14H,3,5,7,9,11-12H2,1-2H3,(H,19,23)(H,20,22)/t14-/m0/s1