[2-oxidanylidene-2-[phenyl-(phenylcarbamoylamino)amino]ethyl] 4-methyl-3-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[phenyl-(phenylcarbamoylamino)amino]ethyl] 4-methyl-3-nitro-benzoate Openeye Name: [2-oxo-2-(N-(phenylcarbamoylamino)anilino)ethyl] 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [2-(N-[[anilino(oxo)methyl]amino]anilino)-2-oxoethyl] ester IUPAC Name: [2-oxo-2-(N-(phenylcarbamoylamino)anilino)ethyl] 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid [2-keto-2-(N-(phenylcarbamoylamino)anilino)ethyl] ester Formula: C23H20N4O6 MolecularWeight: 448.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)N(C2=CC=CC=C2)NC(=O)NC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)N(C2=CC=CC=C2)NC(=O)NC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H20N4O6/c1-16-12-13-17(14-20(16)27(31)32)22(29)33-15-21(28)26(19-10-6-3-7-11-19)25-23(30)24-18-8-4-2-5-9-18/h2-14H,15H2,1H3,(H2,24,25,30)