4-[[6-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]hexanoylamino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[6-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]hexanoylamino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[6-(2,4-dioxo-1H-quinazolin-3-yl)hexanoylamino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[6-(2,4-dioxo-1H-quinazolin-3-yl)-1-oxohexyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[6-(2,4-dioxo-1H-quinazolin-3-yl)hexanoylamino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[6-(2,4-diketo-1H-quinazolin-3-yl)hexanoylamino]methyl]cyclohexanecarboxylic acid Formula: C22H29N3O5 MolecularWeight: 415.48276

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=O)C(=O)O

Isomeric SMILES

C1CC(CCC1CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=O)C(=O)O

InChI

InChI=1S/C22H29N3O5/c26-19(23-14-15-9-11-16(12-10-15)21(28)29)8-2-1-5-13-25-20(27)17-6-3-4-7-18(17)24-22(25)30/h3-4,6-7,15-16H,1-2,5,8-14H2,(H,23,26)(H,24,30)(H,28,29)