methyl (Z)-3-(4-nitro-3-oxidanyl-phenyl)-2-(phenylmethoxycarbonylamino)prop-2-enoate

Systemtic Name: methyl (Z)-3-(4-nitro-3-oxidanyl-phenyl)-2-(phenylmethoxycarbonylamino)prop-2-enoate Openeye Name: methyl (Z)-2-(benzyloxycarbonylamino)-3-(3-hydroxy-4-nitro-phenyl)prop-2-enoate CAS Name: (Z)-3-(3-hydroxy-4-nitrophenyl)-2-(phenylmethoxycarbonylamino)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-(3-hydroxy-4-nitrophenyl)-2-(phenylmethoxycarbonylamino)prop-2-enoate Traditional Name: (Z)-2-(benzyloxycarbonylamino)-3-(3-hydroxy-4-nitro-phenyl)acrylic acid methyl ester Formula: C18H16N2O7 MolecularWeight: 372.32884

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC(=C(C=C1)[N+](=O)[O-])O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)/C(=C/C1=CC(=C(C=C1)[N+](=O)[O-])O)/NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H16N2O7/c1-26-17(22)14(9-13-7-8-15(20(24)25)16(21)10-13)19-18(23)27-11-12-5-3-2-4-6-12/h2-10,21H,11H2,1H3,(H,19,23)/b14-9-