4-[[(2-methylquinolin-1-ium-4-yl)amino]methyl]benzenesulfonamide

Systemtic Name: 4-[[(2-methylquinolin-1-ium-4-yl)amino]methyl]benzenesulfonamide Openeye Name: 4-[[(2-methylquinolin-1-ium-4-yl)amino]methyl]benzenesulfonamide CAS Name: 4-[[(2-methyl-4-quinolin-1-iumyl)amino]methyl]benzenesulfonamide IUPAC Name: 4-[[(2-methylquinolin-1-ium-4-yl)amino]methyl]benzenesulfonamide Traditional Name: 4-[[(2-methylquinolin-1-ium-4-yl)amino]methyl]benzenesulfonamide Formula: C17H18N3O2S+ MolecularWeight: 328.40872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=CC=CC=C2C(=C1)NCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=[NH+]C2=CC=CC=C2C(=C1)NCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C17H17N3O2S/c1-12-10-17(15-4-2-3-5-16(15)20-12)19-11-13-6-8-14(9-7-13)23(18,21)22/h2-10H,11H2,1H3,(H,19,20)(H2,18,21,22)/p+1