3-[4-[(E)-(2-methyl-4-oxidanylidene-quinazolin-3-yl)iminomethyl]-5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl]propanoic acid

Systemtic Name: 3-[4-[(E)-(2-methyl-4-oxidanylidene-quinazolin-3-yl)iminomethyl]-5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl]propanoic acid Openeye Name: 3-[4-[(E)-(2-methyl-4-oxo-quinazolin-3-yl)iminomethyl]-5-oxo-1-phenyl-4H-pyrazol-3-yl]propanoic acid CAS Name: 3-[4-[(E)-(2-methyl-4-oxo-3-quinazolinyl)iminomethyl]-5-oxo-1-phenyl-4H-pyrazol-3-yl]propanoic acid IUPAC Name: 3-[4-[(E)-(2-methyl-4-oxoquinazolin-3-yl)iminomethyl]-5-oxo-1-phenyl-4H-pyrazol-3-yl]propanoic acid Traditional Name: 3-[5-keto-4-[(E)-(4-keto-2-methyl-quinazolin-3-yl)iminomethyl]-1-phenyl-2-pyrazolin-3-yl]propionic acid Formula: C22H19N5O4 MolecularWeight: 417.41736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1N=CC3C(=NN(C3=O)C4=CC=CC=C4)CCC(=O)O

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1/N=C/C3C(=NN(C3=O)C4=CC=CC=C4)CCC(=O)O

InChI

InChI=1S/C22H19N5O4/c1-14-24-18-10-6-5-9-16(18)21(30)26(14)23-13-17-19(11-12-20(28)29)25-27(22(17)31)15-7-3-2-4-8-15/h2-10,13,17H,11-12H2,1H3,(H,28,29)/b23-13+