N-[2-(4-azanylbutyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide

Systemtic Name: N-[2-(4-azanylbutyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide Openeye Name: N-[2-(4-aminobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide CAS Name: N-[2-(4-aminobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide IUPAC Name: N-[2-(4-aminobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide Traditional Name: N-[2-(4-aminobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide Formula: C19H25N3O2S MolecularWeight: 359.4857

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)CCCCN

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)CCCCN

InChI

InChI=1S/C19H25N3O2S/c20-11-4-5-12-22-13-10-16-8-9-18(14-17(16)15-22)21-25(23,24)19-6-2-1-3-7-19/h1-3,6-9,14,21H,4-5,10-13,15,20H2