[[4-[(2-bromophenyl)carbonyldiazenyl]phenyl]amino] 3-methoxybenzoate

Systemtic Name: [[4-[(2-bromophenyl)carbonyldiazenyl]phenyl]amino] 3-methoxybenzoate Openeye Name: [4-(2-bromobenzoyl)azoanilino] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [4-[(2-bromophenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(2-bromobenzoyl)diazenyl]anilino] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [4-(2-bromobenzoyl)azoanilino] ester Formula: C21H16BrN3O4 MolecularWeight: 454.27344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C21H16BrN3O4/c1-28-17-6-4-5-14(13-17)21(27)29-25-16-11-9-15(10-12-16)23-24-20(26)18-7-2-3-8-19(18)22/h2-13,25H,1H3