(2S)-2-phenoxy-2-[(2R,6S)-3,3,6-trimethylazepan-2-yl]ethanol

Systemtic Name: (2S)-2-phenoxy-2-[(2R,6S)-3,3,6-trimethylazepan-2-yl]ethanol Openeye Name: (2S)-2-phenoxy-2-[(2R,6S)-3,3,6-trimethylazepan-2-yl]ethanol CAS Name: (2S)-2-phenoxy-2-[(2R,6S)-3,3,6-trimethyl-2-azepanyl]ethanol IUPAC Name: (2S)-2-phenoxy-2-[(2R,6S)-3,3,6-trimethylazepan-2-yl]ethanol Traditional Name: (2S)-2-phenoxy-2-[(2R,6S)-3,3,6-trimethylazepan-2-yl]ethanol Formula: C17H27NO2 MolecularWeight: 277.40178

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(NC1)C(CO)OC2=CC=CC=C2)(C)C

Isomeric SMILES

C[C@H]1CCC([C@@H](NC1)[C@@H](CO)OC2=CC=CC=C2)(C)C

InChI

InChI=1S/C17H27NO2/c1-13-9-10-17(2,3)16(18-11-13)15(12-19)20-14-7-5-4-6-8-14/h4-8,13,15-16,18-19H,9-12H2,1-3H3/t13-,15+,16-/m0/s1