1,3-benzodioxol-5-ylmethyl-[[4-(diethylamino)phenyl]methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[[4-(diethylamino)phenyl]methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[[4-(diethylamino)phenyl]methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[[4-(diethylamino)phenyl]methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[[4-(diethylamino)phenyl]methyl]azanium Traditional Name: [4-(diethylamino)benzyl]-piperonyl-ammonium Formula: C19H25N2O2+ MolecularWeight: 313.414

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C[NH2+]CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C[NH2+]CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H24N2O2/c1-3-21(4-2)17-8-5-15(6-9-17)12-20-13-16-7-10-18-19(11-16)23-14-22-18/h5-11,20H,3-4,12-14H2,1-2H3/p+1