3-[4-[4-(4-dimethylaminophenyl)buta-1,3-dienyl]pyridin-1-ium-1-yl]propane-1-sulfonate

Systemtic Name: 3-[4-[4-(4-dimethylaminophenyl)buta-1,3-dienyl]pyridin-1-ium-1-yl]propane-1-sulfonate Openeye Name: 3-[4-[4-(4-dimethylaminophenyl)buta-1,3-dienyl]pyridin-1-ium-1-yl]propane-1-sulfonate CAS Name: 3-[4-[4-(4-dimethylaminophenyl)buta-1,3-dienyl]-1-pyridin-1-iumyl]-1-propanesulfonate IUPAC Name: 3-[4-[4-(4-dimethylaminophenyl)buta-1,3-dienyl]pyridin-1-ium-1-yl]propane-1-sulfonate Traditional Name: 3-[4-[4-(4-dimethylaminophenyl)buta-1,3-dienyl]pyridin-1-ium-1-yl]propane-1-sulfonate Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=CC=CC2=CC=[N+](C=C2)CCCS(=O)(=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C=CC=CC2=CC=[N+](C=C2)CCCS(=O)(=O)[O-]

InChI

InChI=1S/C20H24N2O3S/c1-21(2)20-10-8-18(9-11-20)6-3-4-7-19-12-15-22(16-13-19)14-5-17-26(23,24)25/h3-4,6-13,15-16H,5,14,17H2,1-2H3