(5-ethanoyl-2-methoxy-phenyl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-methoxyethylamino)-5-nitrobenzoic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 2-(2-methoxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-methoxyethylamino)-5-nitro-benzoic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C20H22N2O7 MolecularWeight: 402.39788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O7/c1-13(23)14-4-7-19(28-3)15(10-14)12-29-20(24)17-11-16(22(25)26)5-6-18(17)21-8-9-27-2/h4-7,10-11,21H,8-9,12H2,1-3H3