[2-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-5-methoxy-phenyl] 3-nitrobenzoate

Systemtic Name: [2-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-5-methoxy-phenyl] 3-nitrobenzoate Openeye Name: [2-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-5-methoxy-phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]-5-methoxyphenyl] ester IUPAC Name: [2-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-5-methoxyphenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-[(E)-3-(4-chlorophenyl)acryloyl]-5-methoxy-phenyl] ester Formula: C23H16ClNO6 MolecularWeight: 437.82924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C=CC2=CC=C(C=C2)Cl)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)Cl)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H16ClNO6/c1-30-19-10-11-20(21(26)12-7-15-5-8-17(24)9-6-15)22(14-19)31-23(27)16-3-2-4-18(13-16)25(28)29/h2-14H,1H3/b12-7+