4-[3-(3,4-dimethylphenyl)sulfonyl-6-methoxy-quinolin-1-ium-4-yl]morpholine

Systemtic Name: 4-[3-(3,4-dimethylphenyl)sulfonyl-6-methoxy-quinolin-1-ium-4-yl]morpholine Openeye Name: 4-[3-(3,4-dimethylphenyl)sulfonyl-6-methoxy-quinolin-1-ium-4-yl]morpholine CAS Name: 4-[3-(3,4-dimethylphenyl)sulfonyl-6-methoxy-4-quinolin-1-iumyl]morpholine IUPAC Name: 4-[3-(3,4-dimethylphenyl)sulfonyl-6-methoxyquinolin-1-ium-4-yl]morpholine Traditional Name: 4-[3-(3,4-dimethylphenyl)sulfonyl-6-methoxy-quinolin-1-ium-4-yl]morpholine Formula: C22H25N2O4S+ MolecularWeight: 413.5099

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2=C[NH+]=C3C=CC(=CC3=C2N4CCOCC4)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2=C[NH+]=C3C=CC(=CC3=C2N4CCOCC4)OC)C

InChI

InChI=1S/C22H24N2O4S/c1-15-4-6-18(12-16(15)2)29(25,26)21-14-23-20-7-5-17(27-3)13-19(20)22(21)24-8-10-28-11-9-24/h4-7,12-14H,8-11H2,1-3H3/p+1