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

Systemtic Name: ethyl 1-[2-[[2-(2-methylpropylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[2-(isobutylcarbamoyl)anilino]-2-oxo-ethyl]piperidine-3-carboxylate CAS Name: 1-[2-[2-[(2-methylpropylamino)-oxomethyl]anilino]-2-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[2-(2-methylpropylcarbamoyl)anilino]-2-oxoethyl]piperidine-3-carboxylate Traditional Name: 1-[2-[2-(isobutylcarbamoyl)anilino]-2-keto-ethyl]nipecotic acid ethyl ester Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(=O)NC2=CC=CC=C2C(=O)NCC(C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC(=O)NC2=CC=CC=C2C(=O)NCC(C)C

InChI

InChI=1S/C21H31N3O4/c1-4-28-21(27)16-8-7-11-24(13-16)14-19(25)23-18-10-6-5-9-17(18)20(26)22-12-15(2)3/h5-6,9-10,15-16H,4,7-8,11-14H2,1-3H3,(H,22,26)(H,23,25)