[4-methyl-2-[(E)-3-(4-methylphenyl)prop-2-enoyl]phenyl] 3-nitrobenzoate

Systemtic Name: [4-methyl-2-[(E)-3-(4-methylphenyl)prop-2-enoyl]phenyl] 3-nitrobenzoate Openeye Name: [4-methyl-2-[(E)-3-(p-tolyl)prop-2-enoyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-methyl-2-[(E)-3-(4-methylphenyl)-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [4-methyl-2-[(E)-3-(4-methylphenyl)prop-2-enoyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-methyl-2-[(E)-3-(p-tolyl)acryloyl]phenyl] ester Formula: C24H19NO5 MolecularWeight: 401.41136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)C2=C(C=CC(=C2)C)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)C2=C(C=CC(=C2)C)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H19NO5/c1-16-6-9-18(10-7-16)11-12-22(26)21-14-17(2)8-13-23(21)30-24(27)19-4-3-5-20(15-19)25(28)29/h3-15H,1-2H3/b12-11+