(2S)-1-[1-adamantyl-[(3-methoxyphenyl)methyl]amino]-3-(2-methylphenoxy)propan-2-ol

Systemtic Name: (2S)-1-[1-adamantyl-[(3-methoxyphenyl)methyl]amino]-3-(2-methylphenoxy)propan-2-ol Openeye Name: (2S)-1-[1-adamantyl-[(3-methoxyphenyl)methyl]amino]-3-(2-methylphenoxy)propan-2-ol CAS Name: (2S)-1-[1-adamantyl-[(3-methoxyphenyl)methyl]amino]-3-(2-methylphenoxy)-2-propanol IUPAC Name: (2S)-1-[1-adamantyl-[(3-methoxyphenyl)methyl]amino]-3-(2-methylphenoxy)propan-2-ol Traditional Name: (2S)-1-[1-adamantyl(m-anisyl)amino]-3-(2-methylphenoxy)propan-2-ol Formula: C28H37NO3 MolecularWeight: 435.59828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(CN(CC2=CC(=CC=C2)OC)C34CC5CC(C3)CC(C5)C4)O

Isomeric SMILES

CC1=CC=CC=C1OC[C@H](CN(CC2=CC(=CC=C2)OC)C34CC5CC(C3)CC(C5)C4)O

InChI

InChI=1S/C28H37NO3/c1-20-6-3-4-9-27(20)32-19-25(30)18-29(17-21-7-5-8-26(13-21)31-2)28-14-22-10-23(15-28)12-24(11-22)16-28/h3-9,13,22-25,30H,10-12,14-19H2,1-2H3/t22?,23?,24?,25-,28?/m0/s1