methyl (2S)-2-[[1-(2-methylpropyl)-4-oxidanylidene-5-piperidin-1-ylcarbonyl-pyridin-3-yl]carbonylamino]-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-[[1-(2-methylpropyl)-4-oxidanylidene-5-piperidin-1-ylcarbonyl-pyridin-3-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-[[1-isobutyl-4-oxo-5-(piperidine-1-carbonyl)pyridine-3-carbonyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[[1-(2-methylpropyl)-4-oxo-5-[oxo(1-piperidinyl)methyl]-3-pyridinyl]-oxomethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-[[1-(2-methylpropyl)-4-oxo-5-(piperidine-1-carbonyl)pyridine-3-carbonyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[1-isobutyl-4-keto-5-(piperidine-1-carbonyl)nicotinoyl]amino]-2-phenyl-acetic acid methyl ester Formula: C25H31N3O5 MolecularWeight: 453.53074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N2CCCCC2)C(=O)NC(C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(C)CN1C=C(C(=O)C(=C1)C(=O)N2CCCCC2)C(=O)N[C@@H](C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C25H31N3O5/c1-17(2)14-27-15-19(22(29)20(16-27)24(31)28-12-8-5-9-13-28)23(30)26-21(25(32)33-3)18-10-6-4-7-11-18/h4,6-7,10-11,15-17,21H,5,8-9,12-14H2,1-3H3,(H,26,30)/t21-/m0/s1