N-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-1-sulfonamide

Systemtic Name: N-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-1-sulfonamide Openeye Name: N-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-1-sulfonamide CAS Name: N-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)phenyl]-1-naphthalenesulfonamide IUPAC Name: N-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-1-sulfonamide Traditional Name: N-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)phenyl]naphthalene-1-sulfonamide Formula: C27H24N2O4S MolecularWeight: 472.55546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN=C2C3=CC=CC=C3NS(=O)(=O)C4=CC=CC5=CC=CC=C54)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN=C2C3=CC=CC=C3NS(=O)(=O)C4=CC=CC5=CC=CC=C54)OC

InChI

InChI=1S/C27H24N2O4S/c1-32-24-16-19-14-15-28-27(22(19)17-25(24)33-2)21-11-5-6-12-23(21)29-34(30,31)26-13-7-9-18-8-3-4-10-20(18)26/h3-13,16-17,29H,14-15H2,1-2H3