5-[[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]methyl]-2-(4-methylphenyl)-1H-pyrazol-3-one

Systemtic Name: 5-[[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]methyl]-2-(4-methylphenyl)-1H-pyrazol-3-one Openeye Name: 5-[[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]methyl]-2-(p-tolyl)-1H-pyrazol-3-one CAS Name: 5-[[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]methyl]-2-(4-methylphenyl)-1H-pyrazol-3-one IUPAC Name: 5-[[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]methyl]-2-(4-methylphenyl)-1H-pyrazol-3-one Traditional Name: 5-[[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]methyl]-2-(p-tolyl)-3-pyrazolin-3-one Formula: C28H24ClN3O3 MolecularWeight: 485.96146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C=C(N2)CC3=C(N(C4=C3C=C(C=C4)OC)C(=O)C5=CC=C(C=C5)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C=C(N2)CC3=C(N(C4=C3C=C(C=C4)OC)C(=O)C5=CC=C(C=C5)Cl)C

InChI

InChI=1S/C28H24ClN3O3/c1-17-4-10-22(11-5-17)32-27(33)15-21(30-32)14-24-18(2)31(26-13-12-23(35-3)16-25(24)26)28(34)19-6-8-20(29)9-7-19/h4-13,15-16,30H,14H2,1-3H3