4-[3-(4-ethylphenyl)sulfonyl-6-methyl-quinolin-1-ium-4-yl]morpholine

Systemtic Name: 4-[3-(4-ethylphenyl)sulfonyl-6-methyl-quinolin-1-ium-4-yl]morpholine Openeye Name: 4-[3-(4-ethylphenyl)sulfonyl-6-methyl-quinolin-1-ium-4-yl]morpholine CAS Name: 4-[3-(4-ethylphenyl)sulfonyl-6-methyl-4-quinolin-1-iumyl]morpholine IUPAC Name: 4-[3-(4-ethylphenyl)sulfonyl-6-methylquinolin-1-ium-4-yl]morpholine Traditional Name: 4-[3-(4-ethylphenyl)sulfonyl-6-methyl-quinolin-1-ium-4-yl]morpholine Formula: C22H25N2O3S+ MolecularWeight: 397.5105

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)C2=C[NH+]=C3C=CC(=CC3=C2N4CCOCC4)C

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)C2=C[NH+]=C3C=CC(=CC3=C2N4CCOCC4)C

InChI

InChI=1S/C22H24N2O3S/c1-3-17-5-7-18(8-6-17)28(25,26)21-15-23-20-9-4-16(2)14-19(20)22(21)24-10-12-27-13-11-24/h4-9,14-15H,3,10-13H2,1-2H3/p+1