ethyl (E)-6-methyl-4-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]hept-2-enoate

Systemtic Name: ethyl (E)-6-methyl-4-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]hept-2-enoate Openeye Name: ethyl (E)-4-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-6-methyl-hept-2-enoate CAS Name: (E)-6-methyl-4-[[1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]amino]-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-6-methyl-4-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]hept-2-enoate Traditional Name: (E)-4-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-6-methyl-hept-2-enoic acid ethyl ester Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)/C=C/C(CC(C)C)NC(=O)C(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C27H34N2O5/c1-4-33-25(30)16-15-23(17-20(2)3)28-26(31)24(18-21-11-7-5-8-12-21)29-27(32)34-19-22-13-9-6-10-14-22/h5-16,20,23-24H,4,17-19H2,1-3H3,(H,28,31)(H,29,32)/b16-15+