N-cyclopropyl-4-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]benzenesulfonamide

Systemtic Name: N-cyclopropyl-4-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]benzenesulfonamide Openeye Name: N-cyclopropyl-4-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide CAS Name: N-cyclopropyl-4-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-4-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide Traditional Name: N-cyclopropyl-4-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4)OCC

InChI

InChI=1S/C23H28N2O5S/c1-3-29-21-13-17-11-12-25(15-18(17)14-22(21)30-4-2)23(26)16-5-9-20(10-6-16)31(27,28)24-19-7-8-19/h5-6,9-10,13-14,19,24H,3-4,7-8,11-12,15H2,1-2H3