2-(8-fluoranyl-1-methyl-benzo[g]indazol-3-yl)carbonyl-3-(3-methylphenyl)-3-oxidanylidene-propanenitrile

Systemtic Name: 2-(8-fluoranyl-1-methyl-benzo[g]indazol-3-yl)carbonyl-3-(3-methylphenyl)-3-oxidanylidene-propanenitrile Openeye Name: 2-(8-fluoro-1-methyl-benzo[g]indazole-3-carbonyl)-3-(m-tolyl)-3-oxo-propanenitrile CAS Name: 2-[(8-fluoro-1-methyl-3-benzo[g]indazolyl)-oxomethyl]-3-(3-methylphenyl)-3-oxopropanenitrile IUPAC Name: 2-(8-fluoro-1-methylbenzo[g]indazole-3-carbonyl)-3-(3-methylphenyl)-3-oxopropanenitrile Traditional Name: 2-(8-fluoro-1-methyl-benz[g]indazole-3-carbonyl)-3-keto-3-(m-tolyl)propionitrile Formula: C23H16FN3O2 MolecularWeight: 385.390443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C(C#N)C(=O)C2=NN(C3=C2C=CC4=C3C=C(C=C4)F)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)C(C#N)C(=O)C2=NN(C3=C2C=CC4=C3C=C(C=C4)F)C

InChI

InChI=1S/C23H16FN3O2/c1-13-4-3-5-15(10-13)22(28)19(12-25)23(29)20-17-9-7-14-6-8-16(24)11-18(14)21(17)27(2)26-20/h3-11,19H,1-2H3