(1S,3R)-1-azanylcyclopentane-1,3-dicarboxylate; 4-[(2S)-2-azanyl-1-oxidanyl-1-oxidanylidene-propan-2-yl]benzoic acid

Systemtic Name: (1S,3R)-1-azanylcyclopentane-1,3-dicarboxylate; 4-[(2S)-2-azanyl-1-oxidanyl-1-oxidanylidene-propan-2-yl]benzoic acid Openeye Name: (1S,3R)-1-aminocyclopentane-1,3-dicarboxylate; 4-[(1S)-1-amino-2-hydroxy-1-methyl-2-oxo-ethyl]benzoic acid CAS Name: (1S,3R)-1-aminocyclopentane-1,3-dicarboxylate; 4-[(2S)-2-amino-1-hydroxy-1-oxopropan-2-yl]benzoic acid IUPAC Name: (1S,3R)-1-aminocyclopentane-1,3-dicarboxylate; 4-[(2S)-2-amino-1-hydroxy-1-oxopropan-2-yl]benzoic acid Traditional Name: (1S,3R)-1-aminocyclopentane-1,3-dicarboxylate; 4-[(1S)-1-amino-2-hydroxy-2-keto-1-methyl-ethyl]benzoic acid Formula: C17H20N2O8-2 MolecularWeight: 380.3493

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=O)O)(C(=O)O)N.C1CC(CC1C(=O)[O-])(C(=O)[O-])N

Isomeric SMILES

C[C@](C1=CC=C(C=C1)C(=O)O)(C(=O)O)N.C1C[C@](C[C@@H]1C(=O)[O-])(C(=O)[O-])N

InChI

InChI=1S/C10H11NO4.C7H11NO4/c1-10(11,9(14)15)7-4-2-6(3-5-7)8(12)13;8-7(6(11)12)2-1-4(3-7)5(9)10/h2-5H,11H2,1H3,(H,12,13)(H,14,15);4H,1-3,8H2,(H,9,10)(H,11,12)/p-2/t10-;4-,7+/m01/s1