4-azanyl-6-[bis(phenylmethyl)amino]-5-nitro-pyridine-3-carboxylic acid

Systemtic Name: 4-azanyl-6-[bis(phenylmethyl)amino]-5-nitro-pyridine-3-carboxylic acid Openeye Name: 4-amino-6-(dibenzylamino)-5-nitro-pyridine-3-carboxylic acid CAS Name: 4-amino-6-[bis(phenylmethyl)amino]-5-nitro-3-pyridinecarboxylic acid IUPAC Name: 4-amino-6-(dibenzylamino)-5-nitropyridine-3-carboxylic acid Traditional Name: 4-amino-6-(dibenzylamino)-5-nitro-nicotinic acid Formula: C20H18N4O4 MolecularWeight: 378.38132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=C(C(=C3[N+](=O)[O-])N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=C(C(=C3[N+](=O)[O-])N)C(=O)O

InChI

InChI=1S/C20H18N4O4/c21-17-16(20(25)26)11-22-19(18(17)24(27)28)23(12-14-7-3-1-4-8-14)13-15-9-5-2-6-10-15/h1-11H,12-13H2,(H2,21,22)(H,25,26)