(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 3-(4-oxidanylidenequinazolin-3-yl)propanoate

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 3-(4-oxidanylidenequinazolin-3-yl)propanoate Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl 3-(4-oxoquinazolin-3-yl)propanoate CAS Name: 3-(4-oxo-3-quinazolinyl)propanoic acid (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl 3-(4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(4-ketoquinazolin-3-yl)propionic acid (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl ester Formula: C22H19ClN4O3 MolecularWeight: 422.86426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1COC(=O)CCN2C=NC3=CC=CC=C3C2=O)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1COC(=O)CCN2C=NC3=CC=CC=C3C2=O)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H19ClN4O3/c1-15-18(21(23)27(25-15)16-7-3-2-4-8-16)13-30-20(28)11-12-26-14-24-19-10-6-5-9-17(19)22(26)29/h2-10,14H,11-13H2,1H3