(2S,5S)-5-(hydroxymethyl)-1-methyl-2-undecyl-2,4,5,6-tetrahydro-1,4-benzodiazocin-3-one

Systemtic Name: (2S,5S)-5-(hydroxymethyl)-1-methyl-2-undecyl-2,4,5,6-tetrahydro-1,4-benzodiazocin-3-one Openeye Name: (2S,5S)-5-(hydroxymethyl)-1-methyl-2-undecyl-2,4,5,6-tetrahydro-1,4-benzodiazocin-3-one CAS Name: (2S,5S)-5-(hydroxymethyl)-1-methyl-2-undecyl-2,4,5,6-tetrahydro-1,4-benzodiazocin-3-one IUPAC Name: (2S,5S)-5-(hydroxymethyl)-1-methyl-2-undecyl-2,4,5,6-tetrahydro-1,4-benzodiazocin-3-one Traditional Name: (2S,5S)-1-methyl-5-methylol-2-undecyl-2,4,5,6-tetrahydro-1,4-benzodiazocin-3-one Formula: C23H38N2O2 MolecularWeight: 374.56002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1C(=O)NC(CC2=CC=CC=C2N1C)CO

Isomeric SMILES

CCCCCCCCCCC[C@H]1C(=O)N[C@@H](CC2=CC=CC=C2N1C)CO

InChI

InChI=1S/C23H38N2O2/c1-3-4-5-6-7-8-9-10-11-16-22-23(27)24-20(18-26)17-19-14-12-13-15-21(19)25(22)2/h12-15,20,22,26H,3-11,16-18H2,1-2H3,(H,24,27)/t20-,22-/m0/s1