(E)-2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-4-oxidanylidene-4-phenyl-but-2-enoic acid

Systemtic Name: (E)-2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-4-oxidanylidene-4-phenyl-but-2-enoic acid Openeye Name: (E)-2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-4-oxo-4-phenyl-but-2-enoic acid CAS Name: (E)-2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-4-oxo-4-phenyl-2-butenoic acid IUPAC Name: (E)-2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-4-oxo-4-phenylbut-2-enoic acid Traditional Name: (E)-4-keto-2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]-4-phenyl-but-2-enoic acid Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=CC(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N/C(=C/C(=O)C3=CC=CC=C3)/C(=O)O

InChI

InChI=1S/C21H19N3O4/c1-14-19(20(26)24(23(14)2)16-11-7-4-8-12-16)22-17(21(27)28)13-18(25)15-9-5-3-6-10-15/h3-13,22H,1-2H3,(H,27,28)/b17-13+