methyl 3-nitro-5-[(4-phenylmethoxyphenyl)carbamoyl]benzoate

Systemtic Name: methyl 3-nitro-5-[(4-phenylmethoxyphenyl)carbamoyl]benzoate Openeye Name: methyl 3-[(4-benzyloxyphenyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-nitro-5-[oxo-(4-phenylmethoxyanilino)methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-[(4-phenylmethoxyphenyl)carbamoyl]benzoate Traditional Name: 3-[(4-benzoxyphenyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C22H18N2O6 MolecularWeight: 406.38812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N2O6/c1-29-22(26)17-11-16(12-19(13-17)24(27)28)21(25)23-18-7-9-20(10-8-18)30-14-15-5-3-2-4-6-15/h2-13H,14H2,1H3,(H,23,25)