N-[4-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonylphenyl]furan-2-carboxamide

Systemtic Name: N-[4-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonylphenyl]furan-2-carboxamide Openeye Name: N-[4-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]phenyl]furan-2-carboxamide CAS Name: N-[4-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-oxomethyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[4-(6-nitropyridin-3-yl)piperazine-1-carbonyl]phenyl]furan-2-carboxamide Traditional Name: N-[4-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]phenyl]-2-furamide Formula: C21H19N5O5 MolecularWeight: 421.40606

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C21H19N5O5/c27-20(18-2-1-13-31-18)23-16-5-3-15(4-6-16)21(28)25-11-9-24(10-12-25)17-7-8-19(22-14-17)26(29)30/h1-8,13-14H,9-12H2,(H,23,27)