[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methyl-methyl-azanium

Systemtic Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methyl-methyl-azanium Openeye Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methyl-methyl-ammonium CAS Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methyl-methylammonium IUPAC Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methyl-methylazanium Traditional Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzyl]-methyl-ammonium Formula: C17H21N2O2S+ MolecularWeight: 317.42584

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

C[NH2+]CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C17H20N2O2S/c1-18-12-14-6-8-17(9-7-14)22(20,21)19-11-10-15-4-2-3-5-16(15)13-19/h2-9,18H,10-13H2,1H3/p+1