methyl 4-[(3S,4S)-4-(hydroxymethyl)-3-oxidanyl-5-oxidanylidene-5-phenylmethoxy-pentyl]naphthalene-1-carboxylate

Systemtic Name: methyl 4-[(3S,4S)-4-(hydroxymethyl)-3-oxidanyl-5-oxidanylidene-5-phenylmethoxy-pentyl]naphthalene-1-carboxylate Openeye Name: methyl 4-[(3S,4S)-5-benzyloxy-3-hydroxy-4-(hydroxymethyl)-5-oxo-pentyl]naphthalene-1-carboxylate CAS Name: 4-[(3S,4S)-3-hydroxy-4-(hydroxymethyl)-5-oxo-5-phenylmethoxypentyl]-1-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 4-[(3S,4S)-3-hydroxy-4-(hydroxymethyl)-5-oxo-5-phenylmethoxypentyl]naphthalene-1-carboxylate Traditional Name: 4-[(3S,4S)-5-benzoxy-3-hydroxy-5-keto-4-methylol-pentyl]naphthalene-1-carboxylic acid methyl ester Formula: C25H26O6 MolecularWeight: 422.47034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C2=CC=CC=C21)CCC(C(CO)C(=O)OCC3=CC=CC=C3)O

Isomeric SMILES

COC(=O)C1=CC=C(C2=CC=CC=C21)CC[C@@H]([C@H](CO)C(=O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C25H26O6/c1-30-24(28)21-13-11-18(19-9-5-6-10-20(19)21)12-14-23(27)22(15-26)25(29)31-16-17-7-3-2-4-8-17/h2-11,13,22-23,26-27H,12,14-16H2,1H3/t22-,23-/m0/s1