methyl (E,4R)-4-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-5-oxidanyl-pent-2-enoate

Systemtic Name: methyl (E,4R)-4-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-5-oxidanyl-pent-2-enoate Openeye Name: methyl (E,4R)-4-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]-5-hydroxy-pent-2-enoate CAS Name: (E,4R)-5-hydroxy-4-[[(2S)-3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]-2-pentenoic acid methyl ester IUPAC Name: methyl (E,4R)-5-hydroxy-4-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]pent-2-enoate Traditional Name: (E,4R)-4-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]-5-hydroxy-pent-2-enoic acid methyl ester Formula: C19H26N2O6 MolecularWeight: 378.41954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CO)C=CC(=O)OC)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)[C@@H](C(=O)N[C@@H](CO)/C=C/C(=O)OC)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C19H26N2O6/c1-13(2)17(18(24)20-15(11-22)9-10-16(23)26-3)21-19(25)27-12-14-7-5-4-6-8-14/h4-10,13,15,17,22H,11-12H2,1-3H3,(H,20,24)(H,21,25)/b10-9+/t15-,17+/m1/s1