4-[[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]benzoic acid

Systemtic Name: 4-[[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]benzoic acid Openeye Name: 4-[[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]benzoic acid CAS Name: 4-[[3-(4-bromophenyl)-1-phenyl-4-pyrazolyl]methylideneamino]benzoic acid IUPAC Name: 4-[[3-(4-bromophenyl)-1-phenylpyrazol-4-yl]methylideneamino]benzoic acid Traditional Name: 4-[[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]benzoic acid Formula: C23H16BrN3O2 MolecularWeight: 446.29604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Br)C=NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Br)C=NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C23H16BrN3O2/c24-19-10-6-16(7-11-19)22-18(15-27(26-22)21-4-2-1-3-5-21)14-25-20-12-8-17(9-13-20)23(28)29/h1-15H,(H,28,29)