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

Systemtic Name: methyl 3-nitro-5-[(4-phenyldiazenylphenyl)carbamoyl]benzoate Openeye Name: methyl 3-nitro-5-[(4-phenylazophenyl)carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-(4-phenyldiazenylanilino)methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-[(4-phenyldiazenylphenyl)carbamoyl]benzoate Traditional Name: 3-nitro-5-[(4-phenylazophenyl)carbamoyl]benzoic acid methyl ester Formula: C21H16N4O5 MolecularWeight: 404.37554

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O5/c1-30-21(27)15-11-14(12-19(13-15)25(28)29)20(26)22-16-7-9-18(10-8-16)24-23-17-5-3-2-4-6-17/h2-13H,1H3,(H,22,26)