[2-(diethylamino)-2-oxidanylidene-ethyl] 3-(5-methyl-2-thiophen-2-yl-1H-indol-3-yl)propanoate

Systemtic Name: [2-(diethylamino)-2-oxidanylidene-ethyl] 3-(5-methyl-2-thiophen-2-yl-1H-indol-3-yl)propanoate Openeye Name: [2-(diethylamino)-2-oxo-ethyl] 3-[5-methyl-2-(2-thienyl)-1H-indol-3-yl]propanoate CAS Name: 3-(5-methyl-2-thiophen-2-yl-1H-indol-3-yl)propanoic acid [2-(diethylamino)-2-oxoethyl] ester IUPAC Name: [2-(diethylamino)-2-oxoethyl] 3-(5-methyl-2-thiophen-2-yl-1H-indol-3-yl)propanoate Traditional Name: 3-[5-methyl-2-(2-thienyl)-1H-indol-3-yl]propionic acid [2-(diethylamino)-2-keto-ethyl] ester Formula: C22H26N2O3S MolecularWeight: 398.51844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC(=O)CCC1=C(NC2=C1C=C(C=C2)C)C3=CC=CS3

Isomeric SMILES

CCN(CC)C(=O)COC(=O)CCC1=C(NC2=C1C=C(C=C2)C)C3=CC=CS3

InChI

InChI=1S/C22H26N2O3S/c1-4-24(5-2)20(25)14-27-21(26)11-9-16-17-13-15(3)8-10-18(17)23-22(16)19-7-6-12-28-19/h6-8,10,12-13,23H,4-5,9,11,14H2,1-3H3