6-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)propanoyl]amino]hexanoate

Systemtic Name: 6-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)propanoyl]amino]hexanoate Openeye Name: 6-[[(2S)-2-(4-oxoquinazolin-3-yl)propanoyl]amino]hexanoate CAS Name: 6-[[(2S)-1-oxo-2-(4-oxo-3-quinazolinyl)propyl]amino]hexanoate IUPAC Name: 6-[[(2S)-2-(4-oxoquinazolin-3-yl)propanoyl]amino]hexanoate Traditional Name: 6-[[(2S)-2-(4-ketoquinazolin-3-yl)propanoyl]amino]hexanoate Formula: C17H20N3O4- MolecularWeight: 330.3584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCCCC(=O)[O-])N1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

C[C@@H](C(=O)NCCCCCC(=O)[O-])N1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C17H21N3O4/c1-12(16(23)18-10-6-2-3-9-15(21)22)20-11-19-14-8-5-4-7-13(14)17(20)24/h4-5,7-8,11-12H,2-3,6,9-10H2,1H3,(H,18,23)(H,21,22)/p-1/t12-/m0/s1