(4S,5R)-5-(3-chloranyl-4-prop-2-enoxy-phenyl)-2-oxidanylidene-1,3-oxazolidine-4-carboxylic acid

Systemtic Name: (4S,5R)-5-(3-chloranyl-4-prop-2-enoxy-phenyl)-2-oxidanylidene-1,3-oxazolidine-4-carboxylic acid Openeye Name: (4S,5R)-5-(4-allyloxy-3-chloro-phenyl)-2-oxo-oxazolidine-4-carboxylic acid CAS Name: (4S,5R)-5-(3-chloro-4-prop-2-enoxyphenyl)-2-oxo-4-oxazolidinecarboxylic acid IUPAC Name: (4S,5R)-5-(3-chloro-4-prop-2-enoxyphenyl)-2-oxo-1,3-oxazolidine-4-carboxylic acid Traditional Name: (4S,5R)-5-(4-allyloxy-3-chloro-phenyl)-2-keto-oxazolidine-4-carboxylic acid Formula: C13H12ClNO5 MolecularWeight: 297.69108

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=C(C=C(C=C1)C2C(NC(=O)O2)C(=O)O)Cl

Isomeric SMILES

C=CCOC1=C(C=C(C=C1)[C@@H]2[C@H](NC(=O)O2)C(=O)O)Cl

InChI

InChI=1S/C13H12ClNO5/c1-2-5-19-9-4-3-7(6-8(9)14)11-10(12(16)17)15-13(18)20-11/h2-4,6,10-11H,1,5H2,(H,15,18)(H,16,17)/t10-,11+/m0/s1