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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC4=CC(=O)N(N4)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC4=CC(=O)N(N4)CC5=CC=CC=C5

InChI

InChI=1S/C28H24ClN3O3/c1-18-24(14-22-15-27(33)31(30-22)17-19-6-4-3-5-7-19)25-16-23(35-2)12-13-26(25)32(18)28(34)20-8-10-21(29)11-9-20/h3-13,15-16,30H,14,17H2,1-2H3