6-[(2-chloranyl-4-nitro-phenyl)methylamino]pyridine-3-carboxylic acid

Systemtic Name: 6-[(2-chloranyl-4-nitro-phenyl)methylamino]pyridine-3-carboxylic acid Openeye Name: 6-[(2-chloro-4-nitro-phenyl)methylamino]pyridine-3-carboxylic acid CAS Name: 6-[(2-chloro-4-nitrophenyl)methylamino]-3-pyridinecarboxylic acid IUPAC Name: 6-[(2-chloro-4-nitrophenyl)methylamino]pyridine-3-carboxylic acid Traditional Name: 6-[(2-chloro-4-nitro-benzyl)amino]nicotinic acid Formula: C13H10ClN3O4 MolecularWeight: 307.6892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)CNC2=NC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)CNC2=NC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H10ClN3O4/c14-11-5-10(17(20)21)3-1-8(11)6-15-12-4-2-9(7-16-12)13(18)19/h1-5,7H,6H2,(H,15,16)(H,18,19)