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

Systemtic Name: methyl (2S)-2-[(1-cyclopentyl-4-oxidanylidene-5-piperidin-1-ylcarbonyl-pyridin-3-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[1-cyclopentyl-4-oxo-5-(piperidine-1-carbonyl)pyridine-3-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[1-cyclopentyl-4-oxo-5-[oxo(1-piperidinyl)methyl]-3-pyridinyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[1-cyclopentyl-4-oxo-5-(piperidine-1-carbonyl)pyridine-3-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[1-cyclopentyl-4-keto-5-(piperidine-1-carbonyl)nicotinoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C27H33N3O5 MolecularWeight: 479.56802

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CN(C=C(C2=O)C(=O)N3CCCCC3)C4CCCC4

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=CN(C=C(C2=O)C(=O)N3CCCCC3)C4CCCC4

InChI

InChI=1S/C27H33N3O5/c1-35-27(34)23(16-19-10-4-2-5-11-19)28-25(32)21-17-30(20-12-6-7-13-20)18-22(24(21)31)26(33)29-14-8-3-9-15-29/h2,4-5,10-11,17-18,20,23H,3,6-9,12-16H2,1H3,(H,28,32)/t23-/m0/s1