ethyl 6-[5-methoxy-2-(4-phenylthiophen-2-yl)indol-1-yl]hexanoate

Systemtic Name: ethyl 6-[5-methoxy-2-(4-phenylthiophen-2-yl)indol-1-yl]hexanoate Openeye Name: ethyl 6-[5-methoxy-2-(4-phenyl-2-thienyl)indol-1-yl]hexanoate CAS Name: 6-[5-methoxy-2-(4-phenyl-2-thiophenyl)-1-indolyl]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[5-methoxy-2-(4-phenylthiophen-2-yl)indol-1-yl]hexanoate Traditional Name: 6-[5-methoxy-2-(4-phenyl-2-thienyl)indol-1-yl]hexanoic acid ethyl ester Formula: C27H29NO3S MolecularWeight: 447.58906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCN1C2=C(C=C(C=C2)OC)C=C1C3=CC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CCCCCN1C2=C(C=C(C=C2)OC)C=C1C3=CC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C27H29NO3S/c1-3-31-27(29)12-8-5-9-15-28-24-14-13-23(30-2)16-21(24)17-25(28)26-18-22(19-32-26)20-10-6-4-7-11-20/h4,6-7,10-11,13-14,16-19H,3,5,8-9,12,15H2,1-2H3