1-(5-ethylthiophen-2-yl)-3-(5-methyl-2,3,4,5-tetrahydropyridin-1-ium-1-yl)propan-1-olate

Systemtic Name: 1-(5-ethylthiophen-2-yl)-3-(5-methyl-2,3,4,5-tetrahydropyridin-1-ium-1-yl)propan-1-olate Openeye Name: 1-(5-ethyl-2-thienyl)-3-(5-methyl-2,3,4,5-tetrahydropyridin-1-ium-1-yl)propan-1-olate CAS Name: 1-(5-ethyl-2-thiophenyl)-3-(5-methyl-2,3,4,5-tetrahydropyridin-1-ium-1-yl)-1-propanolate IUPAC Name: 1-(5-ethylthiophen-2-yl)-3-(5-methyl-2,3,4,5-tetrahydropyridin-1-ium-1-yl)propan-1-olate Traditional Name: 1-(5-ethyl-2-thienyl)-3-(5-methyl-2,3,4,5-tetrahydropyridin-1-ium-1-yl)propan-1-olate Formula: C15H23NOS MolecularWeight: 265.41422

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(CC[N+]2=CC(CCC2)C)[O-]

Isomeric SMILES

CCC1=CC=C(S1)C(CC[N+]2=CC(CCC2)C)[O-]

InChI

InChI=1S/C15H23NOS/c1-3-13-6-7-15(18-13)14(17)8-10-16-9-4-5-12(2)11-16/h6-7,11-12,14H,3-5,8-10H2,1-2H3