ethyl 2,2-dimethyl-5-[5-[3-(4-methylphenyl)propanoyl]thiophen-2-yl]pentanoate

Systemtic Name: ethyl 2,2-dimethyl-5-[5-[3-(4-methylphenyl)propanoyl]thiophen-2-yl]pentanoate Openeye Name: ethyl 2,2-dimethyl-5-[5-[3-(p-tolyl)propanoyl]-2-thienyl]pentanoate CAS Name: 2,2-dimethyl-5-[5-[3-(4-methylphenyl)-1-oxopropyl]-2-thiophenyl]pentanoic acid ethyl ester IUPAC Name: ethyl 2,2-dimethyl-5-[5-[3-(4-methylphenyl)propanoyl]thiophen-2-yl]pentanoate Traditional Name: 2,2-dimethyl-5-[5-[3-(p-tolyl)propanoyl]-2-thienyl]valeric acid ethyl ester Formula: C23H30O3S MolecularWeight: 386.5475

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CCCC1=CC=C(S1)C(=O)CCC2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C(C)(C)CCCC1=CC=C(S1)C(=O)CCC2=CC=C(C=C2)C

InChI

InChI=1S/C23H30O3S/c1-5-26-22(25)23(3,4)16-6-7-19-13-15-21(27-19)20(24)14-12-18-10-8-17(2)9-11-18/h8-11,13,15H,5-7,12,14,16H2,1-4H3