[4-[2-cyano-3-(2-methyl-1H-indol-3-yl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 4-fluoranylbenzoate

Systemtic Name: [4-[2-cyano-3-(2-methyl-1H-indol-3-yl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 4-fluoranylbenzoate Openeye Name: [4-[2-cyano-3-(2-methyl-1H-indol-3-yl)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-[2-cyano-3-(2-methyl-1H-indol-3-yl)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[2-cyano-3-(2-methyl-1H-indol-3-yl)-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-[2-cyano-3-keto-3-(2-methyl-1H-indol-3-yl)prop-1-enyl]-2-methoxy-phenyl] ester Formula: C27H19FN2O4 MolecularWeight: 454.449163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(=CC3=CC(=C(C=C3)OC(=O)C4=CC=C(C=C4)F)OC)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C(=CC3=CC(=C(C=C3)OC(=O)C4=CC=C(C=C4)F)OC)C#N

InChI

InChI=1S/C27H19FN2O4/c1-16-25(21-5-3-4-6-22(21)30-16)26(31)19(15-29)13-17-7-12-23(24(14-17)33-2)34-27(32)18-8-10-20(28)11-9-18/h3-14,30H,1-2H3