(2-chloranyl-4-nitro-phenyl)methyl 3-[(4-methoxyphenyl)carbonylamino]benzoate

Systemtic Name: (2-chloranyl-4-nitro-phenyl)methyl 3-[(4-methoxyphenyl)carbonylamino]benzoate Openeye Name: (2-chloro-4-nitro-phenyl)methyl 3-[(4-methoxybenzoyl)amino]benzoate CAS Name: 3-[[(4-methoxyphenyl)-oxomethyl]amino]benzoic acid (2-chloro-4-nitrophenyl)methyl ester IUPAC Name: (2-chloro-4-nitrophenyl)methyl 3-[(4-methoxybenzoyl)amino]benzoate Traditional Name: 3-(p-anisoylamino)benzoic acid (2-chloro-4-nitro-benzyl) ester Formula: C22H17ClN2O6 MolecularWeight: 440.83318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=O)OCC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=O)OCC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H17ClN2O6/c1-30-19-9-6-14(7-10-19)21(26)24-17-4-2-3-15(11-17)22(27)31-13-16-5-8-18(25(28)29)12-20(16)23/h2-12H,13H2,1H3,(H,24,26)