methyl (E)-7-phenyl-2-(phenylmethoxycarbonylamino)hept-2-enoate

Systemtic Name: methyl (E)-7-phenyl-2-(phenylmethoxycarbonylamino)hept-2-enoate Openeye Name: methyl (E)-2-(benzyloxycarbonylamino)-7-phenyl-hept-2-enoate CAS Name: (E)-7-phenyl-2-(phenylmethoxycarbonylamino)-2-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-phenyl-2-(phenylmethoxycarbonylamino)hept-2-enoate Traditional Name: (E)-2-(benzyloxycarbonylamino)-7-phenyl-hept-2-enoic acid methyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CCCCCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)/C(=C\CCCCC1=CC=CC=C1)/NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H25NO4/c1-26-21(24)20(16-10-4-7-13-18-11-5-2-6-12-18)23-22(25)27-17-19-14-8-3-9-15-19/h2-3,5-6,8-9,11-12,14-16H,4,7,10,13,17H2,1H3,(H,23,25)/b20-16+