6-[4-(3-nitropyridin-2-yl)piperazin-1-yl]carbonylpyridine-3-carboxylic acid

Systemtic Name: 6-[4-(3-nitropyridin-2-yl)piperazin-1-yl]carbonylpyridine-3-carboxylic acid Openeye Name: 6-[4-(3-nitro-2-pyridyl)piperazine-1-carbonyl]pyridine-3-carboxylic acid CAS Name: 6-[[4-(3-nitro-2-pyridinyl)-1-piperazinyl]-oxomethyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[4-(3-nitropyridin-2-yl)piperazine-1-carbonyl]pyridine-3-carboxylic acid Traditional Name: 6-[4-(3-nitro-2-pyridyl)piperazine-1-carbonyl]nicotinic acid Formula: C16H15N5O5 MolecularWeight: 357.3208

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)[N+](=O)[O-])C(=O)C3=NC=C(C=C3)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)[N+](=O)[O-])C(=O)C3=NC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H15N5O5/c22-15(12-4-3-11(10-18-12)16(23)24)20-8-6-19(7-9-20)14-13(21(25)26)2-1-5-17-14/h1-5,10H,6-9H2,(H,23,24)