(E)-4-oxidanylidene-4-[[2-oxidanylidene-4-phenyl-5-(phenylcarbonyl)pyrimidin-1-yl]amino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[[2-oxidanylidene-4-phenyl-5-(phenylcarbonyl)pyrimidin-1-yl]amino]but-2-enoic acid Openeye Name: (E)-4-[(5-benzoyl-2-oxo-4-phenyl-pyrimidin-1-yl)amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(5-benzoyl-2-oxo-4-phenyl-1-pyrimidinyl)amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(5-benzoyl-2-oxo-4-phenylpyrimidin-1-yl)amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[(5-benzoyl-2-keto-4-phenyl-pyrimidin-1-yl)amino]-4-keto-but-2-enoic acid Formula: C21H15N3O5 MolecularWeight: 389.3609

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=O)N(C=C2C(=O)C3=CC=CC=C3)NC(=O)C=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=O)N(C=C2C(=O)C3=CC=CC=C3)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C21H15N3O5/c25-17(11-12-18(26)27)23-24-13-16(20(28)15-9-5-2-6-10-15)19(22-21(24)29)14-7-3-1-4-8-14/h1-13H,(H,23,25)(H,26,27)/b12-11+