(phenylmethyl) 2-(4-oxidanylidene-2-pyridin-3-yl-quinazolin-3-yl)butanoate

Systemtic Name: (phenylmethyl) 2-(4-oxidanylidene-2-pyridin-3-yl-quinazolin-3-yl)butanoate Openeye Name: benzyl 2-[4-oxo-2-(3-pyridyl)quinazolin-3-yl]butanoate CAS Name: 2-[4-oxo-2-(3-pyridinyl)-3-quinazolinyl]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(4-oxo-2-pyridin-3-ylquinazolin-3-yl)butanoate Traditional Name: 2-[4-keto-2-(3-pyridyl)quinazolin-3-yl]butyric acid benzyl ester Formula: C24H21N3O3 MolecularWeight: 399.44184

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC1=CC=CC=C1)N2C(=NC3=CC=CC=C3C2=O)C4=CN=CC=C4

Isomeric SMILES

CCC(C(=O)OCC1=CC=CC=C1)N2C(=NC3=CC=CC=C3C2=O)C4=CN=CC=C4

InChI

InChI=1S/C24H21N3O3/c1-2-21(24(29)30-16-17-9-4-3-5-10-17)27-22(18-11-8-14-25-15-18)26-20-13-7-6-12-19(20)23(27)28/h3-15,21H,2,16H2,1H3