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

Systemtic Name: 2-methyl-4-thiophen-2-yl-1,3-dihydroisoquinoline-4-carboxylate Openeye Name: 2-methyl-4-(2-thienyl)-1,3-dihydroisoquinoline-4-carboxylate CAS Name: 2-methyl-4-thiophen-2-yl-1,3-dihydroisoquinoline-4-carboxylate IUPAC Name: 2-methyl-4-thiophen-2-yl-1,3-dihydroisoquinoline-4-carboxylate Traditional Name: 2-methyl-4-(2-thienyl)-1,3-dihydroisoquinoline-4-carboxylate Formula: C15H14NO2S- MolecularWeight: 272.34216

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=CC=CC=C2C(C1)(C3=CC=CS3)C(=O)[O-]

Isomeric SMILES

CN1CC2=CC=CC=C2C(C1)(C3=CC=CS3)C(=O)[O-]

InChI

InChI=1S/C15H15NO2S/c1-16-9-11-5-2-3-6-12(11)15(10-16,14(17)18)13-7-4-8-19-13/h2-8H,9-10H2,1H3,(H,17,18)/p-1