1,3-benzodioxol-5-ylmethyl-[(3-ethoxycarbonyl-4-methyl-quinolin-2-yl)methyl]-methyl-azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(3-ethoxycarbonyl-4-methyl-quinolin-2-yl)methyl]-methyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(3-ethoxycarbonyl-4-methyl-2-quinolyl)methyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(3-ethoxycarbonyl-4-methyl-2-quinolinyl)methyl]-methylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(3-ethoxycarbonyl-4-methylquinolin-2-yl)methyl]-methylazanium Traditional Name: (3-carbethoxy-4-methyl-2-quinolyl)methyl-methyl-piperonyl-ammonium Formula: C23H25N2O4+ MolecularWeight: 393.4556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1C[NH+](C)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1C[NH+](C)CC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C23H24N2O4/c1-4-27-23(26)22-15(2)17-7-5-6-8-18(17)24-19(22)13-25(3)12-16-9-10-20-21(11-16)29-14-28-20/h5-11H,4,12-14H2,1-3H3/p+1