1-[1-adamantylmethyl(methyl)amino]-3-(1,3-benzodioxol-5-ylmethoxy)propan-2-ol

Systemtic Name: 1-[1-adamantylmethyl(methyl)amino]-3-(1,3-benzodioxol-5-ylmethoxy)propan-2-ol Openeye Name: 1-[1-adamantylmethyl(methyl)amino]-3-(1,3-benzodioxol-5-ylmethoxy)propan-2-ol CAS Name: 1-[1-adamantylmethyl(methyl)amino]-3-(1,3-benzodioxol-5-ylmethoxy)-2-propanol IUPAC Name: 1-[1-adamantylmethyl(methyl)amino]-3-(1,3-benzodioxol-5-ylmethoxy)propan-2-ol Traditional Name: 1-[1-adamantylmethyl(methyl)amino]-3-piperonyloxy-propan-2-ol Formula: C23H33NO4 MolecularWeight: 387.51242

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(COCC1=CC2=C(C=C1)OCO2)O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN(CC(COCC1=CC2=C(C=C1)OCO2)O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H33NO4/c1-24(14-23-8-17-4-18(9-23)6-19(5-17)10-23)11-20(25)13-26-12-16-2-3-21-22(7-16)28-15-27-21/h2-3,7,17-20,25H,4-6,8-15H2,1H3