[4-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]methyl-diethyl-azanium

Systemtic Name: [4-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]methyl-diethyl-azanium Openeye Name: [4-(1,3-benzodioxole-5-carbonylamino)phenyl]methyl-diethyl-ammonium CAS Name: [4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]phenyl]methyl-diethylammonium IUPAC Name: [4-(1,3-benzodioxole-5-carbonylamino)phenyl]methyl-diethylazanium Traditional Name: diethyl-[4-(piperonyloylamino)benzyl]ammonium Formula: C19H23N2O3+ MolecularWeight: 327.39752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H22N2O3/c1-3-21(4-2)12-14-5-8-16(9-6-14)20-19(22)15-7-10-17-18(11-15)24-13-23-17/h5-11H,3-4,12-13H2,1-2H3,(H,20,22)/p+1