(4,5-dimethoxy-2-methyl-phenyl)methyl-[2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-[2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxo-ethyl]-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-methyl-ammonium CAS Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl]-[(4,5-dimethoxy-2-methylphenyl)methyl]-methylammonium IUPAC Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl]-[(4,5-dimethoxy-2-methylphenyl)methyl]-methylazanium Traditional Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-keto-ethyl]-(4,5-dimethoxy-2-methyl-benzyl)-methyl-ammonium Formula: C22H27N2O6+ MolecularWeight: 415.45958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+](C)CC(=O)NC2=CC3=C(C=C2C(=O)C)OCO3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+](C)CC(=O)NC2=CC3=C(C=C2C(=O)C)OCO3)OC)OC

InChI

InChI=1S/C22H26N2O6/c1-13-6-18(27-4)19(28-5)7-15(13)10-24(3)11-22(26)23-17-9-21-20(29-12-30-21)8-16(17)14(2)25/h6-9H,10-12H2,1-5H3,(H,23,26)/p+1