2-(3,4-dimethoxyphenyl)ethyl-methyl-[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-(isobutylcarbamoylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-methyl-[2-(2-methylpropylcarbamoylamino)-2-oxoethyl]azanium Traditional Name: homoveratryl-[2-(isobutylcarbamoylamino)-2-keto-ethyl]-methyl-ammonium Formula: C18H30N3O4+ MolecularWeight: 352.4485

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)C[NH+](C)CCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CC(C)CNC(=O)NC(=O)C[NH+](C)CCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C18H29N3O4/c1-13(2)11-19-18(23)20-17(22)12-21(3)9-8-14-6-7-15(24-4)16(10-14)25-5/h6-7,10,13H,8-9,11-12H2,1-5H3,(H2,19,20,22,23)/p+1