3-[2-(1,2-dihydropyridin-6-yl)ethyliminomethyl]-2-oxidanyl-cyclohexane-1-carboxylic acid

Systemtic Name: 3-[2-(1,2-dihydropyridin-6-yl)ethyliminomethyl]-2-oxidanyl-cyclohexane-1-carboxylic acid Openeye Name: 3-[2-(1,2-dihydropyridin-6-yl)ethyliminomethyl]-2-hydroxy-cyclohexanecarboxylic acid CAS Name: 3-[2-(1,2-dihydropyridin-6-yl)ethyliminomethyl]-2-hydroxy-1-cyclohexanecarboxylic acid IUPAC Name: 3-[2-(1,2-dihydropyridin-6-yl)ethyliminomethyl]-2-hydroxycyclohexane-1-carboxylic acid Traditional Name: 3-[2-(1,2-dihydropyridin-6-yl)ethyliminomethyl]-2-hydroxy-cyclohexanecarboxylic acid Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C(C1)C(=O)O)O)C=NCCC2=CC=CCN2

Isomeric SMILES

C1CC(C(C(C1)C(=O)O)O)C=NCCC2=CC=CCN2

InChI

InChI=1S/C15H22N2O3/c18-14-11(4-3-6-13(14)15(19)20)10-16-9-7-12-5-1-2-8-17-12/h1-2,5,10-11,13-14,17-18H,3-4,6-9H2,(H,19,20)