[(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-oxidanyl-propyl]-dipropyl-azanium

Systemtic Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-oxidanyl-propyl]-dipropyl-azanium Openeye Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxy-propyl]-dipropyl-ammonium CAS Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxypropyl]-dipropylammonium IUPAC Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxypropyl]-dipropylazanium Traditional Name: [(2R)-2-hydroxy-3-piperonyloxy-propyl]-dipropyl-ammonium Formula: C17H28NO4+ MolecularWeight: 310.40852

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CC(COCC1=CC2=C(C=C1)OCO2)O

Isomeric SMILES

CCC[NH+](CCC)C[C@H](COCC1=CC2=C(C=C1)OCO2)O

InChI

InChI=1S/C17H27NO4/c1-3-7-18(8-4-2)10-15(19)12-20-11-14-5-6-16-17(9-14)22-13-21-16/h5-6,9,15,19H,3-4,7-8,10-13H2,1-2H3/p+1/t15-/m1/s1