1-[6-[(3S)-3-methylpiperidin-1-ium-1-yl]sulfonyliminocyclohexa-2,4-dien-1-ylidene]ethanolate

Systemtic Name: 1-[6-[(3S)-3-methylpiperidin-1-ium-1-yl]sulfonyliminocyclohexa-2,4-dien-1-ylidene]ethanolate Openeye Name: 1-[6-[(3S)-3-methylpiperidin-1-ium-1-yl]sulfonyliminocyclohexa-2,4-dien-1-ylidene]ethanolate CAS Name: 1-[6-[[(3S)-3-methyl-1-piperidin-1-iumyl]sulfonylimino]-1-cyclohexa-2,4-dienylidene]ethanolate IUPAC Name: 1-[6-[(3S)-3-methylpiperidin-1-ium-1-yl]sulfonyliminocyclohexa-2,4-dien-1-ylidene]ethanolate Traditional Name: 1-[6-[(3S)-3-methylpiperidin-1-ium-1-yl]sulfonyliminocyclohexa-2,4-dien-1-ylidene]ethanolate Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)S(=O)(=O)N=C2C=CC=CC2=C(C)[O-]

Isomeric SMILES

C[C@H]1CCC[NH+](C1)S(=O)(=O)N=C2C=CC=CC2=C(C)[O-]

InChI

InChI=1S/C14H20N2O3S/c1-11-6-5-9-16(10-11)20(18,19)15-14-8-4-3-7-13(14)12(2)17/h3-4,7-8,11,17H,5-6,9-10H2,1-2H3/t11-/m0/s1