4-[[2-[(2,5-diphenylpyrazol-3-yl)amino]phenyl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: 4-[[2-[(2,5-diphenylpyrazol-3-yl)amino]phenyl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: 4-[2-[(2,5-diphenylpyrazol-3-yl)amino]anilino]-4-oxo-but-2-enoic acid CAS Name: 4-[2-[(2,5-diphenyl-3-pyrazolyl)amino]anilino]-4-oxo-2-butenoic acid IUPAC Name: 4-[2-[(2,5-diphenylpyrazol-3-yl)amino]anilino]-4-oxobut-2-enoic acid Traditional Name: 4-[2-[(2,5-diphenylpyrazol-3-yl)amino]anilino]-4-keto-but-2-enoic acid Formula: C25H20N4O3 MolecularWeight: 424.4513

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=C2)NC3=CC=CC=C3NC(=O)C=CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=C2)NC3=CC=CC=C3NC(=O)C=CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C25H20N4O3/c30-24(15-16-25(31)32)27-21-14-8-7-13-20(21)26-23-17-22(18-9-3-1-4-10-18)28-29(23)19-11-5-2-6-12-19/h1-17,26H,(H,27,30)(H,31,32)