(1S,2S,3R)-2-(1-azanyl-2-oxidanyl-2-oxidanylidene-ethyl)-3-phenethyl-cyclopropane-1-carboxylic acid

Systemtic Name: (1S,2S,3R)-2-(1-azanyl-2-oxidanyl-2-oxidanylidene-ethyl)-3-phenethyl-cyclopropane-1-carboxylic acid Openeye Name: (1S,2S,3R)-2-(1-amino-2-hydroxy-2-oxo-ethyl)-3-phenethyl-cyclopropanecarboxylic acid CAS Name: (1S,2S,3R)-2-(1-amino-2-hydroxy-2-oxoethyl)-3-phenethyl-1-cyclopropanecarboxylic acid IUPAC Name: (1S,2S,3R)-2-(1-amino-2-hydroxy-2-oxoethyl)-3-phenethylcyclopropane-1-carboxylic acid Traditional Name: (1S,2S,3R)-2-(1-amino-2-hydroxy-2-keto-ethyl)-3-phenethyl-cyclopropanecarboxylic acid Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2C(C2C(=O)O)C(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC[C@@H]2[C@@H]([C@H]2C(=O)O)C(C(=O)O)N

InChI

InChI=1S/C14H17NO4/c15-12(14(18)19)10-9(11(10)13(16)17)7-6-8-4-2-1-3-5-8/h1-5,9-12H,6-7,15H2,(H,16,17)(H,18,19)/t9-,10+,11+,12?/m1/s1