methyl (2S)-2-[[5-(cycloheptylcarbamoyl)-1-cyclopropyl-4-oxidanylidene-pyridin-3-yl]carbonylamino]-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-[[5-(cycloheptylcarbamoyl)-1-cyclopropyl-4-oxidanylidene-pyridin-3-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-[[5-(cycloheptylcarbamoyl)-1-cyclopropyl-4-oxo-pyridine-3-carbonyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[[5-[(cycloheptylamino)-oxomethyl]-1-cyclopropyl-4-oxo-3-pyridinyl]-oxomethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-[[5-(cycloheptylcarbamoyl)-1-cyclopropyl-4-oxopyridine-3-carbonyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[5-(cycloheptylcarbamoyl)-1-cyclopropyl-4-keto-nicotinoyl]amino]-2-phenyl-acetic acid methyl ester Formula: C26H31N3O5 MolecularWeight: 465.54144

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)NC(=O)C2=CN(C=C(C2=O)C(=O)NC3CCCCCC3)C4CC4

Isomeric SMILES

COC(=O)[C@H](C1=CC=CC=C1)NC(=O)C2=CN(C=C(C2=O)C(=O)NC3CCCCCC3)C4CC4

InChI

InChI=1S/C26H31N3O5/c1-34-26(33)22(17-9-5-4-6-10-17)28-25(32)21-16-29(19-13-14-19)15-20(23(21)30)24(31)27-18-11-7-2-3-8-12-18/h4-6,9-10,15-16,18-19,22H,2-3,7-8,11-14H2,1H3,(H,27,31)(H,28,32)/t22-/m0/s1