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

Systemtic Name: [2-[(E)-3-(2-fluorophenyl)prop-2-enoyl]-5-methoxy-phenyl] 3-nitrobenzoate Openeye Name: [2-[(E)-3-(2-fluorophenyl)prop-2-enoyl]-5-methoxy-phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-[(E)-3-(2-fluorophenyl)-1-oxoprop-2-enyl]-5-methoxyphenyl] ester IUPAC Name: [2-[(E)-3-(2-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-[(E)-3-(2-fluorophenyl)acryloyl]-5-methoxy-phenyl] ester Formula: C23H16FNO6 MolecularWeight: 421.374643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C=CC2=CC=CC=C2F)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)/C=C/C2=CC=CC=C2F)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H16FNO6/c1-30-18-10-11-19(21(26)12-9-15-5-2-3-8-20(15)24)22(14-18)31-23(27)16-6-4-7-17(13-16)25(28)29/h2-14H,1H3/b12-9+