(2-ethoxycyclohexa-1,5-dien-1-yl) 2-[(4-oxidanylidenequinazolin-1-yl)methyl]butanoate

Systemtic Name: (2-ethoxycyclohexa-1,5-dien-1-yl) 2-[(4-oxidanylidenequinazolin-1-yl)methyl]butanoate Openeye Name: (2-ethoxycyclohexa-1,5-dien-1-yl) 2-[(4-oxoquinazolin-1-yl)methyl]butanoate CAS Name: 2-[(4-oxo-1-quinazolinyl)methyl]butanoic acid (2-ethoxy-1-cyclohexa-1,5-dienyl) ester IUPAC Name: (2-ethoxycyclohexa-1,5-dien-1-yl) 2-[(4-oxoquinazolin-1-yl)methyl]butanoate Traditional Name: 2-[(4-ketoquinazolin-1-yl)methyl]butyric acid (2-ethoxycyclohexa-1,5-dien-1-yl) ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C=NC(=O)C2=CC=CC=C21)C(=O)OC3=C(CCC=C3)OCC

Isomeric SMILES

CCC(CN1C=NC(=O)C2=CC=CC=C21)C(=O)OC3=C(CCC=C3)OCC

InChI

InChI=1S/C21H24N2O4/c1-3-15(21(25)27-19-12-8-7-11-18(19)26-4-2)13-23-14-22-20(24)16-9-5-6-10-17(16)23/h5-6,8-10,12,14-15H,3-4,7,11,13H2,1-2H3