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

Systemtic Name: 6-[[(2S)-2-(4-oxidanylidenequinazolin-3-yl)-2-phenyl-ethanoyl]amino]hexanoate Openeye Name: 6-[[(2S)-2-(4-oxoquinazolin-3-yl)-2-phenyl-acetyl]amino]hexanoate CAS Name: 6-[[(2S)-1-oxo-2-(4-oxo-3-quinazolinyl)-2-phenylethyl]amino]hexanoate IUPAC Name: 6-[[(2S)-2-(4-oxoquinazolin-3-yl)-2-phenylacetyl]amino]hexanoate Traditional Name: 6-[[(2S)-2-(4-ketoquinazolin-3-yl)-2-phenyl-acetyl]amino]hexanoate Formula: C22H22N3O4- MolecularWeight: 392.42778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NCCCCCC(=O)[O-])N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](C(=O)NCCCCCC(=O)[O-])N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C22H23N3O4/c26-19(27)13-5-2-8-14-23-21(28)20(16-9-3-1-4-10-16)25-15-24-18-12-7-6-11-17(18)22(25)29/h1,3-4,6-7,9-12,15,20H,2,5,8,13-14H2,(H,23,28)(H,26,27)/p-1/t20-/m0/s1