3-(4-ethylphenyl)sulfonyl-4-pyrrolidin-1-yl-quinolin-1-ium

Systemtic Name: 3-(4-ethylphenyl)sulfonyl-4-pyrrolidin-1-yl-quinolin-1-ium Openeye Name: 3-(4-ethylphenyl)sulfonyl-4-pyrrolidin-1-yl-quinolin-1-ium CAS Name: 3-(4-ethylphenyl)sulfonyl-4-(1-pyrrolidinyl)quinolin-1-ium IUPAC Name: 3-(4-ethylphenyl)sulfonyl-4-pyrrolidin-1-ylquinolin-1-ium Traditional Name: 3-(4-ethylphenyl)sulfonyl-4-pyrrolidino-quinolin-1-ium Formula: C21H23N2O2S+ MolecularWeight: 367.48452

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)C2=C(C3=CC=CC=C3[NH+]=C2)N4CCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)C2=C(C3=CC=CC=C3[NH+]=C2)N4CCCC4

InChI

InChI=1S/C21H22N2O2S/c1-2-16-9-11-17(12-10-16)26(24,25)20-15-22-19-8-4-3-7-18(19)21(20)23-13-5-6-14-23/h3-4,7-12,15H,2,5-6,13-14H2,1H3/p+1