3-(4-ethylphenyl)sulfonyl-6-methoxy-4-[(3R)-3-methylpiperidin-1-yl]quinolin-1-ium

Systemtic Name: 3-(4-ethylphenyl)sulfonyl-6-methoxy-4-[(3R)-3-methylpiperidin-1-yl]quinolin-1-ium Openeye Name: 3-(4-ethylphenyl)sulfonyl-6-methoxy-4-[(3R)-3-methyl-1-piperidyl]quinolin-1-ium CAS Name: 3-(4-ethylphenyl)sulfonyl-6-methoxy-4-[(3R)-3-methyl-1-piperidinyl]quinolin-1-ium IUPAC Name: 3-(4-ethylphenyl)sulfonyl-6-methoxy-4-[(3R)-3-methylpiperidin-1-yl]quinolin-1-ium Traditional Name: 3-(4-ethylphenyl)sulfonyl-6-methoxy-4-[(3R)-3-methylpiperidino]quinolin-1-ium Formula: C24H29N2O3S+ MolecularWeight: 425.56366

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)C2=C[NH+]=C3C=CC(=CC3=C2N4CCCC(C4)C)OC

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)C2=C[NH+]=C3C=CC(=CC3=C2N4CCC[C@H](C4)C)OC

InChI

InChI=1S/C24H28N2O3S/c1-4-18-7-10-20(11-8-18)30(27,28)23-15-25-22-12-9-19(29-3)14-21(22)24(23)26-13-5-6-17(2)16-26/h7-12,14-15,17H,4-6,13,16H2,1-3H3/p+1/t17-/m1/s1