3-[(E)-2-chloranyl-3-oxidanyl-octadec-4-enoyl]-4-(phenylmethyl)-1,3-oxazolidin-2-one

Systemtic Name: 3-[(E)-2-chloranyl-3-oxidanyl-octadec-4-enoyl]-4-(phenylmethyl)-1,3-oxazolidin-2-one Openeye Name: 4-benzyl-3-[(E)-2-chloro-3-hydroxy-octadec-4-enoyl]oxazolidin-2-one CAS Name: 3-[(E)-2-chloro-3-hydroxy-1-oxooctadec-4-enyl]-4-(phenylmethyl)-2-oxazolidinone IUPAC Name: 4-benzyl-3-[(E)-2-chloro-3-hydroxyoctadec-4-enoyl]-1,3-oxazolidin-2-one Traditional Name: 4-benzyl-3-[(E)-2-chloro-3-hydroxy-octadec-4-enoyl]oxazolidin-2-one Formula: C28H42ClNO4 MolecularWeight: 492.09038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(C(=O)N1C(COC1=O)CC2=CC=CC=C2)Cl)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/C(C(C(=O)N1C(COC1=O)CC2=CC=CC=C2)Cl)O

InChI

InChI=1S/C28H42ClNO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-25(31)26(29)27(32)30-24(22-34-28(30)33)21-23-18-15-14-16-19-23/h14-20,24-26,31H,2-13,21-22H2,1H3/b20-17+