[2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(4-prop-2-enoxyphenyl)prop-2-enoate

Systemtic Name: [2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(4-prop-2-enoxyphenyl)prop-2-enoate Openeye Name: [2-(4-methoxy-2-nitro-anilino)-2-oxo-ethyl] (E)-3-(4-allyloxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-prop-2-enoxyphenyl)-2-propenoic acid [2-(4-methoxy-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxy-2-nitroanilino)-2-oxoethyl] (E)-3-(4-prop-2-enoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-allyloxyphenyl)acrylic acid [2-keto-2-(4-methoxy-2-nitro-anilino)ethyl] ester Formula: C21H20N2O7 MolecularWeight: 412.3927

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)COC(=O)C=CC2=CC=C(C=C2)OCC=C)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)COC(=O)/C=C/C2=CC=C(C=C2)OCC=C)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O7/c1-3-12-29-16-7-4-15(5-8-16)6-11-21(25)30-14-20(24)22-18-10-9-17(28-2)13-19(18)23(26)27/h3-11,13H,1,12,14H2,2H3,(H,22,24)/b11-6+