ethyl (2R)-1-[1-cyclopropyl-4-oxidanylidene-5-[(phenylmethyl)carbamoyl]pyridin-3-yl]carbonylpiperidine-2-carboxylate

Systemtic Name: ethyl (2R)-1-[1-cyclopropyl-4-oxidanylidene-5-[(phenylmethyl)carbamoyl]pyridin-3-yl]carbonylpiperidine-2-carboxylate Openeye Name: ethyl (2R)-1-[5-(benzylcarbamoyl)-1-cyclopropyl-4-oxo-pyridine-3-carbonyl]piperidine-2-carboxylate CAS Name: (2R)-1-[[1-cyclopropyl-4-oxo-5-[oxo-[(phenylmethyl)amino]methyl]-3-pyridinyl]-oxomethyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R)-1-[5-(benzylcarbamoyl)-1-cyclopropyl-4-oxopyridine-3-carbonyl]piperidine-2-carboxylate Traditional Name: (2R)-1-[5-(benzylcarbamoyl)-1-cyclopropyl-4-keto-nicotinoyl]pipecolinic acid ethyl ester Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1C(=O)C2=CN(C=C(C2=O)C(=O)NCC3=CC=CC=C3)C4CC4

Isomeric SMILES

CCOC(=O)[C@H]1CCCCN1C(=O)C2=CN(C=C(C2=O)C(=O)NCC3=CC=CC=C3)C4CC4

InChI

InChI=1S/C25H29N3O5/c1-2-33-25(32)21-10-6-7-13-28(21)24(31)20-16-27(18-11-12-18)15-19(22(20)29)23(30)26-14-17-8-4-3-5-9-17/h3-5,8-9,15-16,18,21H,2,6-7,10-14H2,1H3,(H,26,30)/t21-/m1/s1