methyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-oxidanylidene-chromene-6-carboxylate

Systemtic Name: methyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-oxidanylidene-chromene-6-carboxylate Openeye Name: methyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-oxo-chromene-6-carboxylate CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-oxo-1-benzopyran-6-carboxylic acid methyl ester IUPAC Name: methyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-oxochromene-6-carboxylate Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-keto-chromene-6-carboxylic acid methyl ester Formula: C20H17NO6S MolecularWeight: 399.41708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OC(=O)C(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OC(=O)C(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H17NO6S/c1-26-19(22)14-6-7-17-16(10-14)11-18(20(23)27-17)28(24,25)21-9-8-13-4-2-3-5-15(13)12-21/h2-7,10-11H,8-9,12H2,1H3