3-carboxy-1-methyl-5-oxidanyl-N-pyridin-2-yl-cyclohexa-2,4-diene-1-carbonitrilium

Systemtic Name: 3-carboxy-1-methyl-5-oxidanyl-N-pyridin-2-yl-cyclohexa-2,4-diene-1-carbonitrilium Openeye Name: 3-carboxy-5-hydroxy-1-methyl-N-(2-pyridyl)cyclohexa-2,4-diene-1-carbonitrilium CAS Name: 3-carboxy-5-hydroxy-1-methyl-N-(2-pyridinyl)-1-cyclohexa-2,4-dienecarbonitrilium IUPAC Name: 3-carboxy-5-hydroxy-1-methyl-N-pyridin-2-ylcyclohexa-2,4-diene-1-carbonitrilium Traditional Name: 3-carboxy-5-hydroxy-1-methyl-N-(2-pyridyl)cyclohexa-2,4-diene-1-carbonitrilium Formula: C14H13N2O3+ MolecularWeight: 257.26462

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=C1)C(=O)O)O)C#[N+]C2=CC=CC=N2

Isomeric SMILES

CC1(CC(=CC(=C1)C(=O)O)O)C#[N+]C2=CC=CC=N2

InChI

InChI=1S/C14H12N2O3/c1-14(9-16-12-4-2-3-5-15-12)7-10(13(18)19)6-11(17)8-14/h2-7H,8H2,1H3,(H-,17,18,19)/p+1