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

Systemtic Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methylazanium Openeye Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methylammonium CAS Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methylammonium IUPAC Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methylazanium Traditional Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzyl]ammonium Formula: C16H19N2O2S+ MolecularWeight: 303.39926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C[NH3+]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C[NH3+]

InChI

InChI=1S/C16H18N2O2S/c17-11-13-5-7-16(8-6-13)21(19,20)18-10-9-14-3-1-2-4-15(14)12-18/h1-8H,9-12,17H2/p+1