6-ethyl-3-(4-methoxyphenyl)sulfonyl-4-piperidin-1-yl-quinolin-1-ium

Systemtic Name: 6-ethyl-3-(4-methoxyphenyl)sulfonyl-4-piperidin-1-yl-quinolin-1-ium Openeye Name: 6-ethyl-3-(4-methoxyphenyl)sulfonyl-4-(1-piperidyl)quinolin-1-ium CAS Name: 6-ethyl-3-(4-methoxyphenyl)sulfonyl-4-(1-piperidinyl)quinolin-1-ium IUPAC Name: 6-ethyl-3-(4-methoxyphenyl)sulfonyl-4-piperidin-1-ylquinolin-1-ium Traditional Name: 6-ethyl-3-(4-methoxyphenyl)sulfonyl-4-piperidino-quinolin-1-ium Formula: C23H27N2O3S+ MolecularWeight: 411.53708

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C(=C[NH+]=C2C=C1)S(=O)(=O)C3=CC=C(C=C3)OC)N4CCCCC4

Isomeric SMILES

CCC1=CC2=C(C(=C[NH+]=C2C=C1)S(=O)(=O)C3=CC=C(C=C3)OC)N4CCCCC4

InChI

InChI=1S/C23H26N2O3S/c1-3-17-7-12-21-20(15-17)23(25-13-5-4-6-14-25)22(16-24-21)29(26,27)19-10-8-18(28-2)9-11-19/h7-12,15-16H,3-6,13-14H2,1-2H3/p+1