4-[7-(phenylsulfonylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-amine

Systemtic Name: 4-[7-(phenylsulfonylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-amine Openeye Name: 4-[7-(benzenesulfonylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-amine CAS Name: 4-[7-(benzenesulfonylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-butanamine IUPAC Name: 4-[7-(benzenesulfonylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]butan-1-amine Traditional Name: 4-[7-(besylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]butylamine Formula: C20H26N2O2S MolecularWeight: 358.49764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O2S/c21-11-4-5-12-22-13-10-18-9-8-17(14-19(18)15-22)16-25(23,24)20-6-2-1-3-7-20/h1-3,6-9,14H,4-5,10-13,15-16,21H2