methyl 2-[6-(4-oxidanylidenequinazolin-3-yl)hexanoylamino]ethanoate

Systemtic Name: methyl 2-[6-(4-oxidanylidenequinazolin-3-yl)hexanoylamino]ethanoate Openeye Name: methyl 2-[6-(4-oxoquinazolin-3-yl)hexanoylamino]acetate CAS Name: 2-[[1-oxo-6-(4-oxo-3-quinazolinyl)hexyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[6-(4-oxoquinazolin-3-yl)hexanoylamino]acetate Traditional Name: 2-[6-(4-ketoquinazolin-3-yl)hexanoylamino]acetic acid methyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CCCCCN1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

COC(=O)CNC(=O)CCCCCN1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C17H21N3O4/c1-24-16(22)11-18-15(21)9-3-2-6-10-20-12-19-14-8-5-4-7-13(14)17(20)23/h4-5,7-8,12H,2-3,6,9-11H2,1H3,(H,18,21)