N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)naphthalene-1-sulfonamide

Systemtic Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)naphthalene-1-sulfonamide Openeye Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)naphthalene-1-sulfonamide CAS Name: N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-1-naphthalenesulfonamide IUPAC Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)naphthalene-1-sulfonamide Traditional Name: N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)naphthalene-1-sulfonamide Formula: C22H22N2O3S MolecularWeight: 394.48668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H22N2O3S/c1-2-22(25)24-13-12-16-10-11-19(14-18(16)15-24)23-28(26,27)21-9-5-7-17-6-3-4-8-20(17)21/h3-11,14,23H,2,12-13,15H2,1H3