(2S,4R)-2-azanyl-4-but-2-ynyl-pentanedioic acid

Systemtic Name: (2S,4R)-2-azanyl-4-but-2-ynyl-pentanedioic acid Openeye Name: (2S,4R)-2-amino-4-but-2-ynyl-pentanedioic acid CAS Name: (2S,4R)-2-amino-4-but-2-ynylpentanedioic acid IUPAC Name: (2S,4R)-2-amino-4-but-2-ynylpentanedioic acid Traditional Name: (2S,4R)-2-amino-4-but-2-ynyl-glutaric acid Formula: C9H13NO4 MolecularWeight: 199.20382

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(CC(C(=O)O)N)C(=O)O

Isomeric SMILES

CC#CC[C@H](C[C@@H](C(=O)O)N)C(=O)O

InChI

InChI=1S/C9H13NO4/c1-2-3-4-6(8(11)12)5-7(10)9(13)14/h6-7H,4-5,10H2,1H3,(H,11,12)(H,13,14)/t6-,7+/m1/s1