5-oxidanylidene-5-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-4-(2,3,3-trimethylbutanoylamino)pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-4-(2,3,3-trimethylbutanoylamino)pentanoic acid Openeye Name: 5-[(1-benzyl-2-hydroxy-2-oxo-ethyl)amino]-5-oxo-4-(2,3,3-trimethylbutanoylamino)pentanoic acid CAS Name: 5-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-5-oxo-4-[(2,3,3-trimethyl-1-oxobutyl)amino]pentanoic acid IUPAC Name: 5-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-5-oxo-4-(2,3,3-trimethylbutanoylamino)pentanoic acid Traditional Name: 5-[(1-benzyl-2-hydroxy-2-keto-ethyl)amino]-5-keto-4-(2,3,3-trimethylbutanoylamino)valeric acid Formula: C21H30N2O6 MolecularWeight: 406.4727

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCC(=O)O)C(=O)NC(CC1=CC=CC=C1)C(=O)O)C(C)(C)C

Isomeric SMILES

CC(C(=O)NC(CCC(=O)O)C(=O)NC(CC1=CC=CC=C1)C(=O)O)C(C)(C)C

InChI

InChI=1S/C21H30N2O6/c1-13(21(2,3)4)18(26)22-15(10-11-17(24)25)19(27)23-16(20(28)29)12-14-8-6-5-7-9-14/h5-9,13,15-16H,10-12H2,1-4H3,(H,22,26)(H,23,27)(H,24,25)(H,28,29)