1-(4-fluorophenyl)-3-[(3-methoxyphenyl)amino]-6,7-dihydro-5H-indazol-4-one

Systemtic Name: 1-(4-fluorophenyl)-3-[(3-methoxyphenyl)amino]-6,7-dihydro-5H-indazol-4-one Openeye Name: 1-(4-fluorophenyl)-3-(3-methoxyanilino)-6,7-dihydro-5H-indazol-4-one CAS Name: 1-(4-fluorophenyl)-3-(3-methoxyanilino)-6,7-dihydro-5H-indazol-4-one IUPAC Name: 1-(4-fluorophenyl)-3-(3-methoxyanilino)-6,7-dihydro-5H-indazol-4-one Traditional Name: 1-(4-fluorophenyl)-3-(m-anisidino)-6,7-dihydro-5H-indazol-4-one Formula: C20H18FN3O2 MolecularWeight: 351.374223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NN(C3=C2C(=O)CCC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NN(C3=C2C(=O)CCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H18FN3O2/c1-26-16-5-2-4-14(12-16)22-20-19-17(6-3-7-18(19)25)24(23-20)15-10-8-13(21)9-11-15/h2,4-5,8-12H,3,6-7H2,1H3,(H,22,23)