(3,5-dimethoxy-4-oxidanyl-phenyl)methyl-[2-[(3,4-dimethoxyphenyl)carbonylamino]ethyl]azanium

Systemtic Name: (3,5-dimethoxy-4-oxidanyl-phenyl)methyl-[2-[(3,4-dimethoxyphenyl)carbonylamino]ethyl]azanium Openeye Name: 2-[(3,4-dimethoxybenzoyl)amino]ethyl-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]ammonium CAS Name: 2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]ethyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]ammonium IUPAC Name: 2-[(3,4-dimethoxybenzoyl)amino]ethyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]azanium Traditional Name: (4-hydroxy-3,5-dimethoxy-benzyl)-[2-(veratroylamino)ethyl]ammonium Formula: C20H27N2O6+ MolecularWeight: 391.43818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC[NH2+]CC2=CC(=C(C(=C2)OC)O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC[NH2+]CC2=CC(=C(C(=C2)OC)O)OC)OC

InChI

InChI=1S/C20H26N2O6/c1-25-15-6-5-14(11-16(15)26-2)20(24)22-8-7-21-12-13-9-17(27-3)19(23)18(10-13)28-4/h5-6,9-11,21,23H,7-8,12H2,1-4H3,(H,22,24)/p+1