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

Systemtic Name: (5S)-2-decyl-5-(hydroxymethyl)-1-methyl-2,4,5,6-tetrahydro-1,4-benzodiazocin-3-one Openeye Name: (5S)-2-decyl-5-(hydroxymethyl)-1-methyl-2,4,5,6-tetrahydro-1,4-benzodiazocin-3-one CAS Name: (5S)-2-decyl-5-(hydroxymethyl)-1-methyl-2,4,5,6-tetrahydro-1,4-benzodiazocin-3-one IUPAC Name: (5S)-2-decyl-5-(hydroxymethyl)-1-methyl-2,4,5,6-tetrahydro-1,4-benzodiazocin-3-one Traditional Name: (5S)-2-decyl-1-methyl-5-methylol-2,4,5,6-tetrahydro-1,4-benzodiazocin-3-one Formula: C22H36N2O2 MolecularWeight: 360.53344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1C(=O)NC(CC2=CC=CC=C2N1C)CO

Isomeric SMILES

CCCCCCCCCCC1C(=O)N[C@@H](CC2=CC=CC=C2N1C)CO

InChI

InChI=1S/C22H36N2O2/c1-3-4-5-6-7-8-9-10-15-21-22(26)23-19(17-25)16-18-13-11-12-14-20(18)24(21)2/h11-14,19,21,25H,3-10,15-17H2,1-2H3,(H,23,26)/t19-,21?/m0/s1