(2S)-3-methyl-2-[[4-oxidanylidene-4-(pyridin-2-ylmethylamino)butanoyl]amino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[[4-oxidanylidene-4-(pyridin-2-ylmethylamino)butanoyl]amino]butanoic acid Openeye Name: (2S)-3-methyl-2-[[4-oxo-4-(2-pyridylmethylamino)butanoyl]amino]butanoic acid CAS Name: (2S)-2-[[1,4-dioxo-4-(2-pyridinylmethylamino)butyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-3-methyl-2-[[4-oxo-4-(pyridin-2-ylmethylamino)butanoyl]amino]butanoic acid Traditional Name: (2S)-2-[[4-keto-4-(2-pyridylmethylamino)butanoyl]amino]-3-methyl-butyric acid Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CCC(=O)NCC1=CC=CC=N1

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)CCC(=O)NCC1=CC=CC=N1

InChI

InChI=1S/C15H21N3O4/c1-10(2)14(15(21)22)18-13(20)7-6-12(19)17-9-11-5-3-4-8-16-11/h3-5,8,10,14H,6-7,9H2,1-2H3,(H,17,19)(H,18,20)(H,21,22)/t14-/m0/s1