[2-(furan-2-ylcarbonylamino)-2-oxidanylidene-ethyl] 5-nitro-2-[(phenylmethyl)amino]benzoate

Systemtic Name: [2-(furan-2-ylcarbonylamino)-2-oxidanylidene-ethyl] 5-nitro-2-[(phenylmethyl)amino]benzoate Openeye Name: [2-(furan-2-carbonylamino)-2-oxo-ethyl] 2-(benzylamino)-5-nitro-benzoate CAS Name: 5-nitro-2-[(phenylmethyl)amino]benzoic acid [2-[[2-furanyl(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(furan-2-carbonylamino)-2-oxoethyl] 2-(benzylamino)-5-nitrobenzoate Traditional Name: 2-(benzylamino)-5-nitro-benzoic acid [2-(2-furoylamino)-2-keto-ethyl] ester Formula: C21H17N3O7 MolecularWeight: 423.37558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)NC(=O)C3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H17N3O7/c25-19(23-20(26)18-7-4-10-30-18)13-31-21(27)16-11-15(24(28)29)8-9-17(16)22-12-14-5-2-1-3-6-14/h1-11,22H,12-13H2,(H,23,25,26)