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

Systemtic Name: 5-[[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]methyl]-2-cyclohexyl-4-methyl-1H-pyrazol-3-one Openeye Name: 5-[[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]methyl]-2-cyclohexyl-4-methyl-1H-pyrazol-3-one CAS Name: 5-[[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]methyl]-2-cyclohexyl-4-methyl-1H-pyrazol-3-one IUPAC Name: 5-[[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]methyl]-2-cyclohexyl-4-methyl-1H-pyrazol-3-one Traditional Name: 5-[[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]methyl]-2-cyclohexyl-4-methyl-3-pyrazolin-3-one Formula: C28H30ClN3O3 MolecularWeight: 492.0091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NN(C1=O)C2CCCCC2)CC3=C(N(C4=C3C=C(C=C4)OC)C(=O)C5=CC=C(C=C5)Cl)C

Isomeric SMILES

CC1=C(NN(C1=O)C2CCCCC2)CC3=C(N(C4=C3C=C(C=C4)OC)C(=O)C5=CC=C(C=C5)Cl)C

InChI

InChI=1S/C28H30ClN3O3/c1-17-25(30-32(27(17)33)21-7-5-4-6-8-21)16-23-18(2)31(26-14-13-22(35-3)15-24(23)26)28(34)19-9-11-20(29)12-10-19/h9-15,21,30H,4-8,16H2,1-3H3