4-(4-quinolin-1-ium-2-ylpiperazin-1-yl)sulfonylaniline

Systemtic Name: 4-(4-quinolin-1-ium-2-ylpiperazin-1-yl)sulfonylaniline Openeye Name: 4-(4-quinolin-1-ium-2-ylpiperazin-1-yl)sulfonylaniline CAS Name: 4-[[4-(2-quinolin-1-iumyl)-1-piperazinyl]sulfonyl]aniline IUPAC Name: 4-(4-quinolin-1-ium-2-ylpiperazin-1-yl)sulfonylaniline Traditional Name: [4-(4-quinolin-1-ium-2-ylpiperazino)sulfonylphenyl]amine Formula: C19H21N4O2S+ MolecularWeight: 369.46064

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=[NH+]C3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=C(C=C4)N

Isomeric SMILES

C1CN(CCN1C2=[NH+]C3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C19H20N4O2S/c20-16-6-8-17(9-7-16)26(24,25)23-13-11-22(12-14-23)19-10-5-15-3-1-2-4-18(15)21-19/h1-10H,11-14,20H2/p+1