3-[(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]chromen-2-one

Systemtic Name: 3-[(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]chromen-2-one Openeye Name: 3-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]chromen-2-one CAS Name: 3-[(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline-2-carbonyl)chromen-2-one Traditional Name: 3-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]coumarin Formula: C25H21NO5S MolecularWeight: 447.50294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC4=CC=CC=C4OC3=O)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC4=CC=CC=C4OC3=O)C5=CC=CS5)OC

InChI

InChI=1S/C25H21NO5S/c1-29-20-13-15-9-10-26(23(22-8-5-11-32-22)17(15)14-21(20)30-2)24(27)18-12-16-6-3-4-7-19(16)31-25(18)28/h3-8,11-14,23H,9-10H2,1-2H3