2-[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-[2-(4-tert-butylphenyl)-2-oxo-ethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[2-(4-tert-butylphenyl)-2-oxoethyl]-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-[2-(4-tert-butylphenyl)-2-oxoethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[2-(4-tert-butylphenyl)-2-keto-ethyl]-4-keto-1H-quinazoline-7-carboxylate Formula: C21H19N2O4- MolecularWeight: 363.38656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C21H20N2O4/c1-21(2,3)14-7-4-12(5-8-14)17(24)11-18-22-16-10-13(20(26)27)6-9-15(16)19(25)23-18/h4-10H,11H2,1-3H3,(H,26,27)(H,22,23,25)/p-1