(2R)-2-[[4-[[2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]ethanoylamino]methyl]cyclohexyl]carbonylamino]propanoic acid

Systemtic Name: (2R)-2-[[4-[[2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]ethanoylamino]methyl]cyclohexyl]carbonylamino]propanoic acid Openeye Name: (2R)-2-[[4-[[[2-(2,4-dioxo-1H-quinazolin-3-yl)acetyl]amino]methyl]cyclohexanecarbonyl]amino]propanoic acid CAS Name: (2R)-2-[[[4-[[[2-(2,4-dioxo-1H-quinazolin-3-yl)-1-oxoethyl]amino]methyl]cyclohexyl]-oxomethyl]amino]propanoic acid IUPAC Name: (2R)-2-[[4-[[[2-(2,4-dioxo-1H-quinazolin-3-yl)acetyl]amino]methyl]cyclohexanecarbonyl]amino]propanoic acid Traditional Name: (2R)-2-[[4-[[[2-(2,4-diketo-1H-quinazolin-3-yl)acetyl]amino]methyl]cyclohexanecarbonyl]amino]propionic acid Formula: C21H26N4O6 MolecularWeight: 430.45434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C1CCC(CC1)CNC(=O)CN2C(=O)C3=CC=CC=C3NC2=O

Isomeric SMILES

C[C@H](C(=O)O)NC(=O)C1CCC(CC1)CNC(=O)CN2C(=O)C3=CC=CC=C3NC2=O

InChI

InChI=1S/C21H26N4O6/c1-12(20(29)30)23-18(27)14-8-6-13(7-9-14)10-22-17(26)11-25-19(28)15-4-2-3-5-16(15)24-21(25)31/h2-5,12-14H,6-11H2,1H3,(H,22,26)(H,23,27)(H,24,31)(H,29,30)/t12-,13?,14?/m1/s1