(4-methoxycarbonylphenyl) 4-(methylamino)-3-nitro-benzoate

Systemtic Name: (4-methoxycarbonylphenyl) 4-(methylamino)-3-nitro-benzoate Openeye Name: (4-methoxycarbonylphenyl) 4-(methylamino)-3-nitro-benzoate CAS Name: 4-(methylamino)-3-nitrobenzoic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 4-(methylamino)-3-nitrobenzoate Traditional Name: 4-(methylamino)-3-nitro-benzoic acid (4-carbomethoxyphenyl) ester Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O6/c1-17-13-8-5-11(9-14(13)18(21)22)16(20)24-12-6-3-10(4-7-12)15(19)23-2/h3-9,17H,1-2H3