6-[[2-(4-oxidanylidenequinazolin-3-yl)-2-phenyl-ethanoyl]amino]hexanoic acid

Systemtic Name: 6-[[2-(4-oxidanylidenequinazolin-3-yl)-2-phenyl-ethanoyl]amino]hexanoic acid Openeye Name: 6-[[2-(4-oxoquinazolin-3-yl)-2-phenyl-acetyl]amino]hexanoic acid CAS Name: 6-[[1-oxo-2-(4-oxo-3-quinazolinyl)-2-phenylethyl]amino]hexanoic acid IUPAC Name: 6-[[2-(4-oxoquinazolin-3-yl)-2-phenylacetyl]amino]hexanoic acid Traditional Name: 6-[[2-(4-ketoquinazolin-3-yl)-2-phenyl-acetyl]amino]hexanoic acid Formula: C22H23N3O4 MolecularWeight: 393.43572

Click to see the large picture

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(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)