3-carboxy-N-indazol-1-yl-5-methyl-5-nitro-cyclohexa-1,3-diene-1-carbonitrilium

Systemtic Name: 3-carboxy-N-indazol-1-yl-5-methyl-5-nitro-cyclohexa-1,3-diene-1-carbonitrilium Openeye Name: 3-carboxy-N-indazol-1-yl-5-methyl-5-nitro-cyclohexa-1,3-diene-1-carbonitrilium CAS Name: 3-carboxy-N-(1-indazolyl)-5-methyl-5-nitro-1-cyclohexa-1,3-dienecarbonitrilium IUPAC Name: 3-carboxy-N-indazol-1-yl-5-methyl-5-nitrocyclohexa-1,3-diene-1-carbonitrilium Traditional Name: 3-carboxy-N-indazol-1-yl-5-methyl-5-nitro-cyclohexa-1,3-diene-1-carbonitrilium Formula: C16H13N4O4+ MolecularWeight: 325.29882

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=C1)C(=O)O)C#[N+]N2C3=CC=CC=C3C=N2)[N+](=O)[O-]

Isomeric SMILES

CC1(CC(=CC(=C1)C(=O)O)C#[N+]N2C3=CC=CC=C3C=N2)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O4/c1-16(20(23)24)7-11(6-13(8-16)15(21)22)9-17-19-14-5-3-2-4-12(14)10-18-19/h2-6,8,10H,7H2,1H3/p+1