4-dibenzothiophen-2-yl-2-methyl-butanoic acid

Systemtic Name: 4-dibenzothiophen-2-yl-2-methyl-butanoic acid Openeye Name: 4-dibenzothiophen-2-yl-2-methyl-butanoic acid CAS Name: 4-(2-dibenzothiophenyl)-2-methylbutanoic acid IUPAC Name: 4-dibenzothiophen-2-yl-2-methylbutanoic acid Traditional Name: 4-dibenzothiophen-2-yl-2-methyl-butyric acid Formula: C17H16O2S MolecularWeight: 284.37274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)SC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(CCC1=CC2=C(C=C1)SC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C17H16O2S/c1-11(17(18)19)6-7-12-8-9-16-14(10-12)13-4-2-3-5-15(13)20-16/h2-5,8-11H,6-7H2,1H3,(H,18,19)