N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-4-methoxy-benzenesulfonamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-4-methoxy-benzenesulfonamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-4-methoxybenzenesulfonamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-4-methoxy-benzenesulfonamide Formula: C22H22N2O5S2 MolecularWeight: 458.55048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H22N2O5S2/c1-29-20-8-12-21(13-9-20)30(25,26)23-19-6-10-22(11-7-19)31(27,28)24-15-14-17-4-2-3-5-18(17)16-24/h2-13,23H,14-16H2,1H3