(phenylmethyl) (4S)-4-[(3-chloranyl-4-oxidanyl-phenyl)methyl]-5-oxidanylidene-1,3-oxazolidine-3-carboxylate

Systemtic Name: (phenylmethyl) (4S)-4-[(3-chloranyl-4-oxidanyl-phenyl)methyl]-5-oxidanylidene-1,3-oxazolidine-3-carboxylate Openeye Name: benzyl (4S)-4-[(3-chloro-4-hydroxy-phenyl)methyl]-5-oxo-oxazolidine-3-carboxylate CAS Name: (4S)-4-[(3-chloro-4-hydroxyphenyl)methyl]-5-oxo-3-oxazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (4S)-4-[(3-chloro-4-hydroxyphenyl)methyl]-5-oxo-1,3-oxazolidine-3-carboxylate Traditional Name: (4S)-4-(3-chloro-4-hydroxy-benzyl)-5-keto-oxazolidine-3-carboxylic acid benzyl ester Formula: C18H16ClNO5 MolecularWeight: 367.732269

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C(C(=O)O1)CC2=CC(=C(C=C2)O)Cl)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1N([C@H](C(=O)O1)C[13C]2=[13CH][13C](=[13C]([13CH]=[13CH]2)O)Cl)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H16ClNO5/c19-14-8-13(6-7-16(14)21)9-15-17(22)25-11-20(15)18(23)24-10-12-4-2-1-3-5-12/h1-8,15,21H,9-11H2/t15-/m0/s1/i6+1,7+1,8+1,13+1,14+1,16+1