(4,5-dimethoxy-2-methyl-phenyl)methyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-[2-[(1-ethoxycarbonyl-4-piperidyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (4,5-dimethoxy-2-methylphenyl)methyl-[2-[(1-ethoxycarbonyl-4-piperidinyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: [2-[(1-carbethoxy-4-piperidyl)amino]-2-keto-ethyl]-(4,5-dimethoxy-2-methyl-benzyl)-methyl-ammonium Formula: C21H34N3O5+ MolecularWeight: 408.51176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+](C)CC2=CC(=C(C=C2C)OC)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+](C)CC2=CC(=C(C=C2C)OC)OC

InChI

InChI=1S/C21H33N3O5/c1-6-29-21(26)24-9-7-17(8-10-24)22-20(25)14-23(3)13-16-12-19(28-5)18(27-4)11-15(16)2/h11-12,17H,6-10,13-14H2,1-5H3,(H,22,25)/p+1