5,5-dimethyl-2-[[(4-oxidanylidenequinazolin-3-yl)amino]methylidene]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[[(4-oxidanylidenequinazolin-3-yl)amino]methylidene]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[[(4-oxoquinazolin-3-yl)amino]methylene]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[[(4-oxo-3-quinazolinyl)amino]methylidene]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[[(4-oxoquinazolin-3-yl)amino]methylidene]cyclohexane-1,3-dione Traditional Name: 2-[[(4-ketoquinazolin-3-yl)amino]methylene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CNN2C=NC3=CC=CC=C3C2=O)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=CNN2C=NC3=CC=CC=C3C2=O)C(=O)C1)C

InChI

InChI=1S/C17H17N3O3/c1-17(2)7-14(21)12(15(22)8-17)9-19-20-10-18-13-6-4-3-5-11(13)16(20)23/h3-6,9-10,19H,7-8H2,1-2H3