(3,4-dimethoxyphenyl)methyl-methyl-phenacyl-(2-phenylethanoyl)azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-methyl-phenacyl-(2-phenylethanoyl)azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-methyl-phenacyl-(2-phenylacetyl)ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-methyl-(1-oxo-2-phenylethyl)-phenacylammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-methyl-phenacyl-(2-phenylacetyl)azanium Traditional Name: methyl-phenacyl-(2-phenylacetyl)-veratryl-ammonium Formula: C26H28NO4+ MolecularWeight: 418.50482

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](CC1=CC(=C(C=C1)OC)OC)(CC(=O)C2=CC=CC=C2)C(=O)CC3=CC=CC=C3

Isomeric SMILES

C[N+](CC1=CC(=C(C=C1)OC)OC)(CC(=O)C2=CC=CC=C2)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C26H28NO4/c1-27(19-23(28)22-12-8-5-9-13-22,26(29)17-20-10-6-4-7-11-20)18-21-14-15-24(30-2)25(16-21)31-3/h4-16H,17-19H2,1-3H3/q+1