O3-[2-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(2-chloro-4,6-dimethyl-anilino)-2-oxo-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 3-O-[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(2-chloro-4,6-dimethyl-anilino)-2-keto-ethyl] ester O1-ethyl ester Formula: C20H19ClN2O7 MolecularWeight: 434.82706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2=C(C=C(C=C2Cl)C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2=C(C=C(C=C2Cl)C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H19ClN2O7/c1-4-29-19(25)13-7-14(9-15(8-13)23(27)28)20(26)30-10-17(24)22-18-12(3)5-11(2)6-16(18)21/h5-9H,4,10H2,1-3H3,(H,22,24)