3-methyl-5-oxidanylidene-5-[5-(3-phenylpropyl)thiophen-2-yl]pentanoic acid

Systemtic Name: 3-methyl-5-oxidanylidene-5-[5-(3-phenylpropyl)thiophen-2-yl]pentanoic acid Openeye Name: 3-methyl-5-oxo-5-[5-(3-phenylpropyl)-2-thienyl]pentanoic acid CAS Name: 3-methyl-5-oxo-5-[5-(3-phenylpropyl)-2-thiophenyl]pentanoic acid IUPAC Name: 3-methyl-5-oxo-5-[5-(3-phenylpropyl)thiophen-2-yl]pentanoic acid Traditional Name: 5-keto-3-methyl-5-[5-(3-phenylpropyl)-2-thienyl]valeric acid Formula: C19H22O3S MolecularWeight: 330.44118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=CC=C(S1)CCCC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

CC(CC(=O)C1=CC=C(S1)CCCC2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C19H22O3S/c1-14(13-19(21)22)12-17(20)18-11-10-16(23-18)9-5-8-15-6-3-2-4-7-15/h2-4,6-7,10-11,14H,5,8-9,12-13H2,1H3,(H,21,22)