[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 4-(1H-indol-3-yl)butanoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 4-(1H-indol-3-yl)butanoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C19H20N2O3S MolecularWeight: 356.4387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCCC(=O)OCC(=O)NCC3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCCC(=O)OCC(=O)NCC3=CC=CS3

InChI

InChI=1S/C19H20N2O3S/c22-18(21-12-15-6-4-10-25-15)13-24-19(23)9-3-5-14-11-20-17-8-2-1-7-16(14)17/h1-2,4,6-8,10-11,20H,3,5,9,12-13H2,(H,21,22)