2-(1-adamantyl)-1-(1,3-benzodioxol-5-yl)propan-1-amine

Systemtic Name: 2-(1-adamantyl)-1-(1,3-benzodioxol-5-yl)propan-1-amine Openeye Name: 2-(1-adamantyl)-1-(1,3-benzodioxol-5-yl)propan-1-amine CAS Name: 2-(1-adamantyl)-1-(1,3-benzodioxol-5-yl)-1-propanamine IUPAC Name: 2-(1-adamantyl)-1-(1,3-benzodioxol-5-yl)propan-1-amine Traditional Name: [2-(1-adamantyl)-1-(1,3-benzodioxol-5-yl)propyl]amine Formula: C20H27NO2 MolecularWeight: 313.43388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC2=C(C=C1)OCO2)N)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C(C1=CC2=C(C=C1)OCO2)N)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H27NO2/c1-12(19(21)16-2-3-17-18(7-16)23-11-22-17)20-8-13-4-14(9-20)6-15(5-13)10-20/h2-3,7,12-15,19H,4-6,8-11,21H2,1H3