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

Systemtic Name: [4-chloranyl-2-[(E)-3-(4-fluorophenyl)prop-2-enoyl]phenyl] 4-nitrobenzoate Openeye Name: [4-chloro-2-[(E)-3-(4-fluorophenyl)prop-2-enoyl]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-chloro-2-[(E)-3-(4-fluorophenyl)-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [4-chloro-2-[(E)-3-(4-fluorophenyl)prop-2-enoyl]phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-chloro-2-[(E)-3-(4-fluorophenyl)acryloyl]phenyl] ester Formula: C22H13ClFNO5 MolecularWeight: 425.793723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)C2=C(C=CC(=C2)Cl)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

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

InChI

InChI=1S/C22H13ClFNO5/c23-16-6-12-21(30-22(27)15-4-9-18(10-5-15)25(28)29)19(13-16)20(26)11-3-14-1-7-17(24)8-2-14/h1-13H/b11-3+