3-(4-chlorophenyl)sulfonyl-N-(phenylmethyl)quinolin-1-ium-4-amine

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-N-(phenylmethyl)quinolin-1-ium-4-amine Openeye Name: N-benzyl-3-(4-chlorophenyl)sulfonyl-quinolin-1-ium-4-amine CAS Name: 3-(4-chlorophenyl)sulfonyl-N-(phenylmethyl)-4-quinolin-1-iumamine IUPAC Name: N-benzyl-3-(4-chlorophenyl)sulfonylquinolin-1-ium-4-amine Traditional Name: benzyl-[3-(4-chlorophenyl)sulfonylquinolin-1-ium-4-yl]amine Formula: C22H18ClN2O2S+ MolecularWeight: 409.90852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=[NH+]C3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=[NH+]C3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClN2O2S/c23-17-10-12-18(13-11-17)28(26,27)21-15-24-20-9-5-4-8-19(20)22(21)25-14-16-6-2-1-3-7-16/h1-13,15H,14H2,(H,24,25)/p+1