2-methyl-4-(4-methyldibenzothiophen-2-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 2-methyl-4-(4-methyldibenzothiophen-2-yl)-4-oxidanylidene-butanoic acid Openeye Name: 2-methyl-4-(4-methyldibenzothiophen-2-yl)-4-oxo-butanoic acid CAS Name: 2-methyl-4-(4-methyl-2-dibenzothiophenyl)-4-oxobutanoic acid IUPAC Name: 2-methyl-4-(4-methyldibenzothiophen-2-yl)-4-oxobutanoic acid Traditional Name: 4-keto-2-methyl-4-(4-methyldibenzothiophen-2-yl)butyric acid Formula: C18H16O3S MolecularWeight: 312.38284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C(=O)CC(C)C(=O)O)C3=CC=CC=C3S2

Isomeric SMILES

CC1=C2C(=CC(=C1)C(=O)CC(C)C(=O)O)C3=CC=CC=C3S2

InChI

InChI=1S/C18H16O3S/c1-10-7-12(15(19)8-11(2)18(20)21)9-14-13-5-3-4-6-16(13)22-17(10)14/h3-7,9,11H,8H2,1-2H3,(H,20,21)