2-[(4-methyl-3-nitro-phenyl)amino]pyridine-4-carboxylate

Systemtic Name: 2-[(4-methyl-3-nitro-phenyl)amino]pyridine-4-carboxylate Openeye Name: 2-(4-methyl-3-nitro-anilino)pyridine-4-carboxylate CAS Name: 2-(4-methyl-3-nitroanilino)-4-pyridinecarboxylate IUPAC Name: 2-(4-methyl-3-nitroanilino)pyridine-4-carboxylate Traditional Name: 2-(4-methyl-3-nitro-anilino)isonicotinate Formula: C13H10N3O4- MolecularWeight: 272.2362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC=CC(=C2)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC=CC(=C2)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O4/c1-8-2-3-10(7-11(8)16(19)20)15-12-6-9(13(17)18)4-5-14-12/h2-7H,1H3,(H,14,15)(H,17,18)/p-1