[2-(furan-2-ylcarbonylamino)-2-oxidanylidene-ethyl] 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate

Systemtic Name: [2-(furan-2-ylcarbonylamino)-2-oxidanylidene-ethyl] 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate Openeye Name: [2-(furan-2-carbonylamino)-2-oxo-ethyl] 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate CAS Name: 2-[(2-chlorophenyl)methylamino]-5-nitrobenzoic acid [2-[[2-furanyl(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(furan-2-carbonylamino)-2-oxoethyl] 2-[(2-chlorophenyl)methylamino]-5-nitrobenzoate Traditional Name: 2-[(2-chlorobenzyl)amino]-5-nitro-benzoic acid [2-(2-furoylamino)-2-keto-ethyl] ester Formula: C21H16ClN3O7 MolecularWeight: 457.82064

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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)Cl

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)Cl

InChI

InChI=1S/C21H16ClN3O7/c22-16-5-2-1-4-13(16)11-23-17-8-7-14(25(29)30)10-15(17)21(28)32-12-19(26)24-20(27)18-6-3-9-31-18/h1-10,23H,11-12H2,(H,24,26,27)