[(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-(3-methylbutyl)azanium

Systemtic Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-(3-methylbutyl)azanium Openeye Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-isopentyl-ammonium CAS Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-(3-methylbutyl)ammonium IUPAC Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-(3-methylbutyl)azanium Traditional Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-isoamyl-ammonium Formula: C16H26NO2+ MolecularWeight: 264.38314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH2+]C(C)CCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

C[C@H](CCC1=CC2=C(C=C1)OCO2)[NH2+]CCC(C)C

InChI

InChI=1S/C16H25NO2/c1-12(2)8-9-17-13(3)4-5-14-6-7-15-16(10-14)19-11-18-15/h6-7,10,12-13,17H,4-5,8-9,11H2,1-3H3/p+1/t13-/m1/s1