4-[[2-(4-oxidanylidenequinazolin-3-yl)propanoylamino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[2-(4-oxidanylidenequinazolin-3-yl)propanoylamino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[2-(4-oxoquinazolin-3-yl)propanoylamino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[1-oxo-2-(4-oxo-3-quinazolinyl)propyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[2-(4-oxoquinazolin-3-yl)propanoylamino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[2-(4-ketoquinazolin-3-yl)propanoylamino]methyl]cyclohexanecarboxylic acid Formula: C19H23N3O4 MolecularWeight: 357.40362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCC(CC1)C(=O)O)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C(=O)NCC1CCC(CC1)C(=O)O)N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H23N3O4/c1-12(22-11-21-16-5-3-2-4-15(16)18(22)24)17(23)20-10-13-6-8-14(9-7-13)19(25)26/h2-5,11-14H,6-10H2,1H3,(H,20,23)(H,25,26)