6-[[4-[(4-oxidanylidenequinazolin-3-yl)methyl]cyclohexyl]carbonylamino]hexanoic acid

Systemtic Name: 6-[[4-[(4-oxidanylidenequinazolin-3-yl)methyl]cyclohexyl]carbonylamino]hexanoic acid Openeye Name: 6-[[4-[(4-oxoquinazolin-3-yl)methyl]cyclohexanecarbonyl]amino]hexanoic acid CAS Name: 6-[[oxo-[4-[(4-oxo-3-quinazolinyl)methyl]cyclohexyl]methyl]amino]hexanoic acid IUPAC Name: 6-[[4-[(4-oxoquinazolin-3-yl)methyl]cyclohexanecarbonyl]amino]hexanoic acid Traditional Name: 6-[[4-[(4-ketoquinazolin-3-yl)methyl]cyclohexanecarbonyl]amino]hexanoic acid Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN2C=NC3=CC=CC=C3C2=O)C(=O)NCCCCCC(=O)O

Isomeric SMILES

C1CC(CCC1CN2C=NC3=CC=CC=C3C2=O)C(=O)NCCCCCC(=O)O

InChI

InChI=1S/C22H29N3O4/c26-20(27)8-2-1-5-13-23-21(28)17-11-9-16(10-12-17)14-25-15-24-19-7-4-3-6-18(19)22(25)29/h3-4,6-7,15-17H,1-2,5,8-14H2,(H,23,28)(H,26,27)