butyl 4-[2-[(2,3-dimethyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: butyl 4-[2-[(2,3-dimethyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: butyl 4-[2-(2,3-dimethyl-6-nitro-anilino)-2-oxo-ethoxy]benzoate CAS Name: 4-[2-(2,3-dimethyl-6-nitroanilino)-2-oxoethoxy]benzoic acid butyl ester IUPAC Name: butyl 4-[2-(2,3-dimethyl-6-nitroanilino)-2-oxoethoxy]benzoate Traditional Name: 4-[2-(2,3-dimethyl-6-nitro-anilino)-2-keto-ethoxy]benzoic acid butyl ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)OCC(=O)NC2=C(C=CC(=C2C)C)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)OCC(=O)NC2=C(C=CC(=C2C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O6/c1-4-5-12-28-21(25)16-7-9-17(10-8-16)29-13-19(24)22-20-15(3)14(2)6-11-18(20)23(26)27/h6-11H,4-5,12-13H2,1-3H3,(H,22,24)