(phenylmethyl) 3-[[(2S)-2-[(4-methoxy-4-oxidanylidene-butanoyl)amino]-3-phenyl-propanoyl]amino]-4-oxidanylidene-piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-[[(2S)-2-[(4-methoxy-4-oxidanylidene-butanoyl)amino]-3-phenyl-propanoyl]amino]-4-oxidanylidene-piperidine-1-carboxylate Openeye Name: benzyl 3-[[(2S)-2-[(4-methoxy-4-oxo-butanoyl)amino]-3-phenyl-propanoyl]amino]-4-oxo-piperidine-1-carboxylate CAS Name: 3-[[(2S)-2-[(4-methoxy-1,4-dioxobutyl)amino]-1-oxo-3-phenylpropyl]amino]-4-oxo-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[(2S)-2-[(4-methoxy-4-oxobutanoyl)amino]-3-phenylpropanoyl]amino]-4-oxopiperidine-1-carboxylate Traditional Name: 4-keto-3-[[(2S)-2-[(4-keto-4-methoxy-butanoyl)amino]-3-phenyl-propanoyl]amino]piperidine-1-carboxylic acid benzyl ester Formula: C27H31N3O7 MolecularWeight: 509.55094

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)NC(CC1=CC=CC=C1)C(=O)NC2CN(CCC2=O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC2CN(CCC2=O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H31N3O7/c1-36-25(33)13-12-24(32)28-21(16-19-8-4-2-5-9-19)26(34)29-22-17-30(15-14-23(22)31)27(35)37-18-20-10-6-3-7-11-20/h2-11,21-22H,12-18H2,1H3,(H,28,32)(H,29,34)/t21-,22?/m0/s1