(4-ethanoylphenyl) 4-(2-methoxyethylamino)-3-nitro-benzoate

Systemtic Name: (4-ethanoylphenyl) 4-(2-methoxyethylamino)-3-nitro-benzoate Openeye Name: (4-acetylphenyl) 4-(2-methoxyethylamino)-3-nitro-benzoate CAS Name: 4-(2-methoxyethylamino)-3-nitrobenzoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 4-(2-methoxyethylamino)-3-nitrobenzoate Traditional Name: 4-(2-methoxyethylamino)-3-nitro-benzoic acid (4-acetylphenyl) ester Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O6/c1-12(21)13-3-6-15(7-4-13)26-18(22)14-5-8-16(19-9-10-25-2)17(11-14)20(23)24/h3-8,11,19H,9-10H2,1-2H3