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

Systemtic Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-[(2R)-1-oxidanylbutan-2-yl]azanium Openeye Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-[(1R)-1-(hydroxymethyl)propyl]ammonium CAS Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-[(2R)-1-hydroxybutan-2-yl]ammonium IUPAC Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-[(2R)-1-hydroxybutan-2-yl]azanium Traditional Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-[(1R)-1-methylolpropyl]ammonium Formula: C15H24NO3+ MolecularWeight: 266.35596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23NO3/c1-3-13(9-17)16-11(2)4-5-12-6-7-14-15(8-12)19-10-18-14/h6-8,11,13,16-17H,3-5,9-10H2,1-2H3/p+1/t11-,13-/m1/s1