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

Systemtic Name: [2-[(E)-3-(2-fluorophenyl)prop-2-enoyl]-4-methyl-phenyl] 3-nitrobenzoate Openeye Name: [2-[(E)-3-(2-fluorophenyl)prop-2-enoyl]-4-methyl-phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-[(E)-3-(2-fluorophenyl)-1-oxoprop-2-enyl]-4-methylphenyl] ester IUPAC Name: [2-[(E)-3-(2-fluorophenyl)prop-2-enoyl]-4-methylphenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-[(E)-3-(2-fluorophenyl)acryloyl]-4-methyl-phenyl] ester Formula: C23H16FNO5 MolecularWeight: 405.375243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)C=CC3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)/C=C/C3=CC=CC=C3F

InChI

InChI=1S/C23H16FNO5/c1-15-9-12-22(30-23(27)17-6-4-7-18(14-17)25(28)29)19(13-15)21(26)11-10-16-5-2-3-8-20(16)24/h2-14H,1H3/b11-10+