N-(1,3-benzodioxol-5-ylmethyl)-2-[2,2-dimethyl-4-(3-methylbutyl)oxan-4-yl]ethanamine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2,2-dimethyl-4-(3-methylbutyl)oxan-4-yl]ethanamine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-isopentyl-2,2-dimethyl-tetrahydropyran-4-yl)ethanamine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2,2-dimethyl-4-(3-methylbutyl)-4-oxanyl]ethanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2,2-dimethyl-4-(3-methylbutyl)oxan-4-yl]ethanamine Traditional Name: 2-(4-isoamyl-2,2-dimethyl-tetrahydropyran-4-yl)ethyl-piperonyl-amine Formula: C22H35NO3 MolecularWeight: 361.5182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(CCOC(C1)(C)C)CCNCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)CCC1(CCOC(C1)(C)C)CCNCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C22H35NO3/c1-17(2)7-8-22(10-12-26-21(3,4)15-22)9-11-23-14-18-5-6-19-20(13-18)25-16-24-19/h5-6,13,17,23H,7-12,14-16H2,1-4H3