methyl (E,5S)-4-oxidanylidene-5-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]hex-2-enoate

Systemtic Name: methyl (E,5S)-4-oxidanylidene-5-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]hex-2-enoate Openeye Name: methyl (E,5S)-5-[[(2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-4-oxo-hex-2-enoate CAS Name: (E,5S)-4-oxo-5-[[(2S)-1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]amino]-2-hexenoic acid methyl ester IUPAC Name: methyl (E,5S)-4-oxo-5-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]hex-2-enoate Traditional Name: (E,5S)-5-[[(2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-4-keto-hex-2-enoic acid methyl ester Formula: C24H26N2O6 MolecularWeight: 438.47304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C=CC(=O)OC)NC(=O)C(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)/C=C/C(=O)OC)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C24H26N2O6/c1-17(21(27)13-14-22(28)31-2)25-23(29)20(15-18-9-5-3-6-10-18)26-24(30)32-16-19-11-7-4-8-12-19/h3-14,17,20H,15-16H2,1-2H3,(H,25,29)(H,26,30)/b14-13+/t17-,20-/m0/s1