3,3-dimethyl-5-oxidanylidene-5-[[(3S)-2-oxidanylideneazepan-3-yl]amino]pentanoic acid

Systemtic Name: 3,3-dimethyl-5-oxidanylidene-5-[[(3S)-2-oxidanylideneazepan-3-yl]amino]pentanoic acid Openeye Name: 3,3-dimethyl-5-oxo-5-[[(3S)-2-oxoazepan-3-yl]amino]pentanoic acid CAS Name: 3,3-dimethyl-5-oxo-5-[[(3S)-2-oxo-3-azepanyl]amino]pentanoic acid IUPAC Name: 3,3-dimethyl-5-oxo-5-[[(3S)-2-oxoazepan-3-yl]amino]pentanoic acid Traditional Name: 5-keto-5-[[(3S)-2-ketoazepan-3-yl]amino]-3,3-dimethyl-valeric acid Formula: C13H22N2O4 MolecularWeight: 270.32478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1CCCCNC1=O)CC(=O)O

Isomeric SMILES

CC(C)(CC(=O)N[C@H]1CCCCNC1=O)CC(=O)O

InChI

InChI=1S/C13H22N2O4/c1-13(2,8-11(17)18)7-10(16)15-9-5-3-4-6-14-12(9)19/h9H,3-8H2,1-2H3,(H,14,19)(H,15,16)(H,17,18)/t9-/m0/s1