1-(4-azanyl-2,3,6-trimethyl-phenoxy)-3-[4-(4-phenoxyphenyl)piperidin-1-yl]propan-2-ol

Systemtic Name: 1-(4-azanyl-2,3,6-trimethyl-phenoxy)-3-[4-(4-phenoxyphenyl)piperidin-1-yl]propan-2-ol Openeye Name: 1-(4-amino-2,3,6-trimethyl-phenoxy)-3-[4-(4-phenoxyphenyl)-1-piperidyl]propan-2-ol CAS Name: 1-(4-amino-2,3,6-trimethylphenoxy)-3-[4-(4-phenoxyphenyl)-1-piperidinyl]-2-propanol IUPAC Name: 1-(4-amino-2,3,6-trimethylphenoxy)-3-[4-(4-phenoxyphenyl)piperidin-1-yl]propan-2-ol Traditional Name: 1-(4-amino-2,3,6-trimethyl-phenoxy)-3-[4-(4-phenoxyphenyl)piperidino]propan-2-ol Formula: C29H36N2O3 MolecularWeight: 460.60774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1OCC(CN2CCC(CC2)C3=CC=C(C=C3)OC4=CC=CC=C4)O)C)C)N

Isomeric SMILES

CC1=CC(=C(C(=C1OCC(CN2CCC(CC2)C3=CC=C(C=C3)OC4=CC=CC=C4)O)C)C)N

InChI

InChI=1S/C29H36N2O3/c1-20-17-28(30)21(2)22(3)29(20)33-19-25(32)18-31-15-13-24(14-16-31)23-9-11-27(12-10-23)34-26-7-5-4-6-8-26/h4-12,17,24-25,32H,13-16,18-19,30H2,1-3H3