(2,5-dimethoxyphenyl)methyl 4-[(2-nitrophenyl)amino]butanoate

Systemtic Name: (2,5-dimethoxyphenyl)methyl 4-[(2-nitrophenyl)amino]butanoate Openeye Name: (2,5-dimethoxyphenyl)methyl 4-(2-nitroanilino)butanoate CAS Name: 4-(2-nitroanilino)butanoic acid (2,5-dimethoxyphenyl)methyl ester IUPAC Name: (2,5-dimethoxyphenyl)methyl 4-(2-nitroanilino)butanoate Traditional Name: 4-(2-nitroanilino)butyric acid (2,5-dimethoxybenzyl) ester Formula: C19H22N2O6 MolecularWeight: 374.38778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)COC(=O)CCCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)COC(=O)CCCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C19H22N2O6/c1-25-15-9-10-18(26-2)14(12-15)13-27-19(22)8-5-11-20-16-6-3-4-7-17(16)21(23)24/h3-4,6-7,9-10,12,20H,5,8,11,13H2,1-2H3