2-methoxyethyl 4-[(4-chloranyl-3-nitro-phenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 2-methoxyethyl 4-[(4-chloranyl-3-nitro-phenyl)amino]-4-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl 4-(4-chloro-3-nitro-anilino)-4-oxo-butanoate CAS Name: 4-(4-chloro-3-nitroanilino)-4-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-(4-chloro-3-nitroanilino)-4-oxobutanoate Traditional Name: 4-(4-chloro-3-nitro-anilino)-4-keto-butyric acid 2-methoxyethyl ester Formula: C13H15ClN2O6 MolecularWeight: 330.721

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)CCC(=O)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

COCCOC(=O)CCC(=O)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H15ClN2O6/c1-21-6-7-22-13(18)5-4-12(17)15-9-2-3-10(14)11(8-9)16(19)20/h2-3,8H,4-7H2,1H3,(H,15,17)