(phenylmethyl) N-[(2S,3S)-5-methylidene-3-oxidanyl-6-oxidanylidene-heptan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S,3S)-5-methylidene-3-oxidanyl-6-oxidanylidene-heptan-2-yl]carbamate Openeye Name: benzyl N-[(1S,2S)-2-hydroxy-1-methyl-4-methylene-5-oxo-hexyl]carbamate CAS Name: N-[(2S,3S)-3-hydroxy-5-methylene-6-oxoheptan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S,3S)-3-hydroxy-5-methylidene-6-oxoheptan-2-yl]carbamate Traditional Name: N-[(1S,2S)-4-acetyl-2-hydroxy-1-methyl-pent-4-enyl]carbamic acid benzyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC(=C)C(=O)C)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

C[C@@H]([C@H](CC(=C)C(=O)C)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H21NO4/c1-11(13(3)18)9-15(19)12(2)17-16(20)21-10-14-7-5-4-6-8-14/h4-8,12,15,19H,1,9-10H2,2-3H3,(H,17,20)/t12-,15-/m0/s1