ethyl 3-nitro-5-[[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]carbamoyl]benzoate

Systemtic Name: ethyl 3-nitro-5-[[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]carbamoyl]benzoate Openeye Name: ethyl 3-nitro-5-[[2-oxo-2-(2,4,6-trimethylanilino)ethyl]carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-[[2-oxo-2-(2,4,6-trimethylanilino)ethyl]carbamoyl]benzoate Traditional Name: 3-[(2-keto-2-mesidino-ethyl)carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NCC(=O)NC2=C(C=C(C=C2C)C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NCC(=O)NC2=C(C=C(C=C2C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O6/c1-5-30-21(27)16-8-15(9-17(10-16)24(28)29)20(26)22-11-18(25)23-19-13(3)6-12(2)7-14(19)4/h6-10H,5,11H2,1-4H3,(H,22,26)(H,23,25)