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

Systemtic Name: 2-methoxyethyl 4-[(2-methyl-4-nitro-phenyl)amino]-4-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl 4-(2-methyl-4-nitro-anilino)-4-oxo-butanoate CAS Name: 4-(2-methyl-4-nitroanilino)-4-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-(2-methyl-4-nitroanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(2-methyl-4-nitro-anilino)butyric acid 2-methoxyethyl ester Formula: C14H18N2O6 MolecularWeight: 310.30252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCC(=O)OCCOC

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCC(=O)OCCOC

InChI

InChI=1S/C14H18N2O6/c1-10-9-11(16(19)20)3-4-12(10)15-13(17)5-6-14(18)22-8-7-21-2/h3-4,9H,5-8H2,1-2H3,(H,15,17)