2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonyl-3-nitro-benzoic acid

Systemtic Name: 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonyl-3-nitro-benzoic acid Openeye Name: 2-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-3-nitro-benzoic acid CAS Name: 2-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-3-nitrobenzoic acid IUPAC Name: 2-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-3-nitrobenzoic acid Traditional Name: 2-[4-(2-furoyl)piperazine-1-carbonyl]-3-nitro-benzoic acid Formula: C17H15N3O7 MolecularWeight: 373.3169

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CO2)C(=O)C3=C(C=CC=C3[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CO2)C(=O)C3=C(C=CC=C3[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H15N3O7/c21-15(13-5-2-10-27-13)18-6-8-19(9-7-18)16(22)14-11(17(23)24)3-1-4-12(14)20(25)26/h1-5,10H,6-9H2,(H,23,24)