(2R)-2-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]carbamoylamino]-3-methyl-butanoic acid

Systemtic Name: (2R)-2-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]carbamoylamino]-3-methyl-butanoic acid Openeye Name: (2R)-2-[[2-(azepan-1-yl)-2-oxo-ethyl]carbamoylamino]-3-methyl-butanoic acid CAS Name: (2R)-2-[[[[2-(1-azepanyl)-2-oxoethyl]amino]-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: (2R)-2-[[2-(azepan-1-yl)-2-oxoethyl]carbamoylamino]-3-methylbutanoic acid Traditional Name: (2R)-2-[[2-(azepan-1-yl)-2-keto-ethyl]carbamoylamino]-3-methyl-butyric acid Formula: C14H25N3O4 MolecularWeight: 299.366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)NCC(=O)N1CCCCCC1

Isomeric SMILES

CC(C)[C@H](C(=O)O)NC(=O)NCC(=O)N1CCCCCC1

InChI

InChI=1S/C14H25N3O4/c1-10(2)12(13(19)20)16-14(21)15-9-11(18)17-7-5-3-4-6-8-17/h10,12H,3-9H2,1-2H3,(H,19,20)(H2,15,16,21)/t12-/m1/s1