methyl 3-[(5-nitrofuran-2-yl)carbonylamino]-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate

Systemtic Name: methyl 3-[(5-nitrofuran-2-yl)carbonylamino]-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate Openeye Name: methyl 4-(4-benzoylpiperazin-1-yl)-3-[(5-nitrofuran-2-carbonyl)amino]benzoate CAS Name: 4-(4-benzoyl-1-piperazinyl)-3-[[(5-nitro-2-furanyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(4-benzoylpiperazin-1-yl)-3-[(5-nitrofuran-2-carbonyl)amino]benzoate Traditional Name: 4-(4-benzoylpiperazino)-3-[(5-nitro-2-furoyl)amino]benzoic acid methyl ester Formula: C24H22N4O7 MolecularWeight: 478.45408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C24H22N4O7/c1-34-24(31)17-7-8-19(18(15-17)25-22(29)20-9-10-21(35-20)28(32)33)26-11-13-27(14-12-26)23(30)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3,(H,25,29)