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

Systemtic Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-(4-methylcyclohexyl)azanium Openeye Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-(4-methylcyclohexyl)ammonium CAS Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-(4-methylcyclohexyl)ammonium IUPAC Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-(4-methylcyclohexyl)azanium Traditional Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-(4-methylcyclohexyl)ammonium Formula: C18H28NO2+ MolecularWeight: 290.42042

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)[NH2+]C(C)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1CCC(CC1)[NH2+][C@H](C)CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H27NO2/c1-13-3-8-16(9-4-13)19-14(2)5-6-15-7-10-17-18(11-15)21-12-20-17/h7,10-11,13-14,16,19H,3-6,8-9,12H2,1-2H3/p+1/t13?,14-,16?/m1/s1