2-(2-methylphenyl)-4-(propylsulfinylmethyl)cyclopentane-1,3-dione

Systemtic Name: 2-(2-methylphenyl)-4-(propylsulfinylmethyl)cyclopentane-1,3-dione Openeye Name: 2-(o-tolyl)-4-(propylsulfinylmethyl)cyclopentane-1,3-dione CAS Name: 2-(2-methylphenyl)-4-(propylsulfinylmethyl)cyclopentane-1,3-dione IUPAC Name: 2-(2-methylphenyl)-4-(propylsulfinylmethyl)cyclopentane-1,3-dione Traditional Name: 2-(o-tolyl)-4-(propylsulfinylmethyl)cyclopentane-1,3-quinone Formula: C16H20O3S MolecularWeight: 292.3932

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)CC1CC(=O)C(C1=O)C2=CC=CC=C2C

Isomeric SMILES

CCCS(=O)CC1CC(=O)C(C1=O)C2=CC=CC=C2C

InChI

InChI=1S/C16H20O3S/c1-3-8-20(19)10-12-9-14(17)15(16(12)18)13-7-5-4-6-11(13)2/h4-7,12,15H,3,8-10H2,1-2H3