(2S,5S)-5-(hydroxymethyl)-2-propan-2-yl-1-undecyl-5,6-dihydro-2H-4,1-benzoxazocin-3-one

Systemtic Name: (2S,5S)-5-(hydroxymethyl)-2-propan-2-yl-1-undecyl-5,6-dihydro-2H-4,1-benzoxazocin-3-one Openeye Name: (2S,5S)-5-(hydroxymethyl)-2-isopropyl-1-undecyl-5,6-dihydro-2H-4,1-benzoxazocin-3-one CAS Name: (2S,5S)-5-(hydroxymethyl)-2-propan-2-yl-1-undecyl-5,6-dihydro-2H-4,1-benzoxazocin-3-one IUPAC Name: (2S,5S)-5-(hydroxymethyl)-2-propan-2-yl-1-undecyl-5,6-dihydro-2H-4,1-benzoxazocin-3-one Traditional Name: (2S,5S)-2-isopropyl-5-methylol-1-undecyl-5,6-dihydro-2H-4,1-benzoxazocin-3-one Formula: C25H41NO3 MolecularWeight: 403.59794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCN1C(C(=O)OC(CC2=CC=CC=C21)CO)C(C)C

Isomeric SMILES

CCCCCCCCCCCN1[C@H](C(=O)O[C@@H](CC2=CC=CC=C21)CO)C(C)C

InChI

InChI=1S/C25H41NO3/c1-4-5-6-7-8-9-10-11-14-17-26-23-16-13-12-15-21(23)18-22(19-27)29-25(28)24(26)20(2)3/h12-13,15-16,20,22,24,27H,4-11,14,17-19H2,1-3H3/t22-,24-/m0/s1