potassium 1-ethyl-3-(3-ethylphenyl)-4-methoxy-5-(2-propylphenyl)pyridin-1-ium sulfate

Systemtic Name: potassium 1-ethyl-3-(3-ethylphenyl)-4-methoxy-5-(2-propylphenyl)pyridin-1-ium sulfate Openeye Name: potassium 1-ethyl-3-(3-ethylphenyl)-4-methoxy-5-(2-propylphenyl)pyridin-1-ium sulfate CAS Name: potassium 1-ethyl-3-(3-ethylphenyl)-4-methoxy-5-(2-propylphenyl)pyridin-1-ium sulfate IUPAC Name: potassium 1-ethyl-3-(3-ethylphenyl)-4-methoxy-5-(2-propylphenyl)pyridin-1-ium sulfate Traditional Name: potassium 1-ethyl-3-(3-ethylphenyl)-4-methoxy-5-(2-propylphenyl)pyridin-1-ium sulfate Formula: C25H30KNO5S MolecularWeight: 495.6727

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1C2=C(C(=C[N+](=C2)CC)C3=CC(=CC=C3)CC)OC.[O-]S(=O)(=O)[O-].[K+]

Isomeric SMILES

CCCC1=CC=CC=C1C2=C(C(=C[N+](=C2)CC)C3=CC(=CC=C3)CC)OC.[O-]S(=O)(=O)[O-].[K+]

InChI

InChI=1S/C25H30NO.K.H2O4S/c1-5-11-20-13-8-9-15-22(20)24-18-26(7-3)17-23(25(24)27-4)21-14-10-12-19(6-2)16-21;;1-5(2,3)4/h8-10,12-18H,5-7,11H2,1-4H3;;(H2,1,2,3,4)/q2*+1;/p-2