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

Systemtic Name: 4-(4-methyldibenzothiophen-2-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-methyldibenzothiophen-2-yl)-4-oxo-butanoic acid CAS Name: 4-(4-methyl-2-dibenzothiophenyl)-4-oxobutanoic acid IUPAC Name: 4-(4-methyldibenzothiophen-2-yl)-4-oxobutanoic acid Traditional Name: 4-keto-4-(4-methyldibenzothiophen-2-yl)butyric acid Formula: C17H14O3S MolecularWeight: 298.35626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14O3S/c1-10-8-11(14(18)6-7-16(19)20)9-13-12-4-2-3-5-15(12)21-17(10)13/h2-5,8-9H,6-7H2,1H3,(H,19,20)