2-methyl-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxylate

Systemtic Name: 2-methyl-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxylate Openeye Name: 2-methyl-1-oxo-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxylate CAS Name: 2-methyl-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxylate IUPAC Name: 2-methyl-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxylate Traditional Name: 1-keto-2-methyl-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxylate Formula: C15H12NO3S- MolecularWeight: 286.32568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC=CC=C2C1=O)C(=O)[O-])C3=CC=CS3

Isomeric SMILES

CN1C(C(C2=CC=CC=C2C1=O)C(=O)[O-])C3=CC=CS3

InChI

InChI=1S/C15H13NO3S/c1-16-13(11-7-4-8-20-11)12(15(18)19)9-5-2-3-6-10(9)14(16)17/h2-8,12-13H,1H3,(H,18,19)/p-1