[(3Z,5S,6R)-5-oxidanyl-7-phenylmethoxy-6,9-bis(phenylmethoxymethyl)-5,6-dihydro-2H-1-benzazocin-1-yl] ethanoate

Systemtic Name: [(3Z,5S,6R)-5-oxidanyl-7-phenylmethoxy-6,9-bis(phenylmethoxymethyl)-5,6-dihydro-2H-1-benzazocin-1-yl] ethanoate Openeye Name: [(3Z,5S,6R)-7-benzyloxy-6,9-bis(benzyloxymethyl)-5-hydroxy-5,6-dihydro-2H-1-benzazocin-1-yl] acetate CAS Name: acetic acid [(3Z,5S,6R)-5-hydroxy-7-phenylmethoxy-6,9-bis(phenylmethoxymethyl)-5,6-dihydro-2H-1-benzazocin-1-yl] ester IUPAC Name: [(3Z,5S,6R)-5-hydroxy-7-phenylmethoxy-6,9-bis(phenylmethoxymethyl)-5,6-dihydro-2H-1-benzazocin-1-yl] acetate Traditional Name: acetic acid [(3Z,5S,6R)-7-benzoxy-6,9-bis(benzoxymethyl)-5-hydroxy-5,6-dihydro-2H-1-benzazocin-1-yl] ester Formula: C36H37NO6 MolecularWeight: 579.68208

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON1CC=CC(C(C2=C1C=C(C=C2OCC3=CC=CC=C3)COCC4=CC=CC=C4)COCC5=CC=CC=C5)O

Isomeric SMILES

CC(=O)ON1C/C=C\[C@@H]([C@H](C2=C1C=C(C=C2OCC3=CC=CC=C3)COCC4=CC=CC=C4)COCC5=CC=CC=C5)O

InChI

InChI=1S/C36H37NO6/c1-27(38)43-37-19-11-18-34(39)32(26-41-23-29-14-7-3-8-15-29)36-33(37)20-31(24-40-22-28-12-5-2-6-13-28)21-35(36)42-25-30-16-9-4-10-17-30/h2-18,20-21,32,34,39H,19,22-26H2,1H3/b18-11-/t32-,34+/m1/s1