4-methoxy-1-methyl-3-propan-2-yl-5-(3-propan-2-yloxyphenyl)pyridin-1-ium sulfate

Systemtic Name: 4-methoxy-1-methyl-3-propan-2-yl-5-(3-propan-2-yloxyphenyl)pyridin-1-ium sulfate Openeye Name: 3-(3-isopropoxyphenyl)-5-isopropyl-4-methoxy-1-methyl-pyridin-1-ium sulfate CAS Name: 4-methoxy-1-methyl-3-propan-2-yl-5-(3-propan-2-yloxyphenyl)pyridin-1-ium sulfate IUPAC Name: 4-methoxy-1-methyl-3-propan-2-yl-5-(3-propan-2-yloxyphenyl)pyridin-1-ium sulfate Traditional Name: 3-(3-isopropoxyphenyl)-5-isopropyl-4-methoxy-1-methyl-pyridin-1-ium sulfate Formula: C19H26NO6S- MolecularWeight: 396.47784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C[N+](=C1)C)C2=CC(=CC=C2)OC(C)C)OC.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC(C)C1=C(C(=C[N+](=C1)C)C2=CC(=CC=C2)OC(C)C)OC.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C19H26NO2.H2O4S/c1-13(2)17-11-20(5)12-18(19(17)21-6)15-8-7-9-16(10-15)22-14(3)4;1-5(2,3)4/h7-14H,1-6H3;(H2,1,2,3,4)/q+1;/p-2