methyl (2R,3S)-2-benzamido-3-oxidanyl-octanoate

Systemtic Name: methyl (2R,3S)-2-benzamido-3-oxidanyl-octanoate Openeye Name: methyl (2R,3S)-2-benzamido-3-hydroxy-octanoate CAS Name: (2R,3S)-2-benzamido-3-hydroxyoctanoic acid methyl ester IUPAC Name: methyl (2R,3S)-2-benzamido-3-hydroxyoctanoate Traditional Name: (2R,3S)-2-benzamido-3-hydroxy-caprylic acid methyl ester Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C(=O)OC)NC(=O)C1=CC=CC=C1)O

Isomeric SMILES

CCCCC[C@@H]([C@H](C(=O)OC)NC(=O)C1=CC=CC=C1)O

InChI

InChI=1S/C16H23NO4/c1-3-4-6-11-13(18)14(16(20)21-2)17-15(19)12-9-7-5-8-10-12/h5,7-10,13-14,18H,3-4,6,11H2,1-2H3,(H,17,19)/t13-,14+/m0/s1