1,3-benzodioxol-5-ylmethyl-[(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl]-ethyl-azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl]-ethyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(2-chloro-7,8-dimethyl-3-quinolyl)methyl]-ethyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(2-chloro-7,8-dimethyl-3-quinolinyl)methyl]-ethylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(2-chloro-7,8-dimethylquinolin-3-yl)methyl]-ethylazanium Traditional Name: (2-chloro-7,8-dimethyl-3-quinolyl)methyl-ethyl-piperonyl-ammonium Formula: C22H24ClN2O2+ MolecularWeight: 383.89116

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC2=C(C=C1)OCO2)CC3=C(N=C4C(=C(C=CC4=C3)C)C)Cl

Isomeric SMILES

CC[NH+](CC1=CC2=C(C=C1)OCO2)CC3=C(N=C4C(=C(C=CC4=C3)C)C)Cl

InChI

InChI=1S/C22H23ClN2O2/c1-4-25(11-16-6-8-19-20(9-16)27-13-26-19)12-18-10-17-7-5-14(2)15(3)21(17)24-22(18)23/h5-10H,4,11-13H2,1-3H3/p+1