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

Systemtic Name: 5-[(1-butanoyl-5-methoxy-2-methyl-indol-3-yl)methyl]-2-cyclohexyl-1H-pyrazol-3-one Openeye Name: 5-[(1-butanoyl-5-methoxy-2-methyl-indol-3-yl)methyl]-2-cyclohexyl-1H-pyrazol-3-one CAS Name: 2-cyclohexyl-5-[[5-methoxy-2-methyl-1-(1-oxobutyl)-3-indolyl]methyl]-1H-pyrazol-3-one IUPAC Name: 5-[(1-butanoyl-5-methoxy-2-methylindol-3-yl)methyl]-2-cyclohexyl-1H-pyrazol-3-one Traditional Name: 5-[(1-butyryl-5-methoxy-2-methyl-indol-3-yl)methyl]-2-cyclohexyl-3-pyrazolin-3-one Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(=C(C2=C1C=CC(=C2)OC)CC3=CC(=O)N(N3)C4CCCCC4)C

Isomeric SMILES

CCCC(=O)N1C(=C(C2=C1C=CC(=C2)OC)CC3=CC(=O)N(N3)C4CCCCC4)C

InChI

InChI=1S/C24H31N3O3/c1-4-8-23(28)26-16(2)20(21-15-19(30-3)11-12-22(21)26)13-17-14-24(29)27(25-17)18-9-6-5-7-10-18/h11-12,14-15,18,25H,4-10,13H2,1-3H3