(2,3-dimethoxyphenyl)methyl-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (2,3-dimethoxyphenyl)methyl-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (2,3-dimethoxyphenyl)methyl-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-methyl-ammonium CAS Name: (2,3-dimethoxyphenyl)methyl-[2-[4-(4-hydroxyphenyl)-1-piperazinyl]-2-oxoethyl]-methylammonium IUPAC Name: (2,3-dimethoxyphenyl)methyl-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxoethyl]-methylazanium Traditional Name: [2-[4-(4-hydroxyphenyl)piperazino]-2-keto-ethyl]-methyl-o-veratryl-ammonium Formula: C22H30N3O4+ MolecularWeight: 400.4913

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C(=CC=C1)OC)OC)CC(=O)N2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

C[NH+](CC1=C(C(=CC=C1)OC)OC)CC(=O)N2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C22H29N3O4/c1-23(15-17-5-4-6-20(28-2)22(17)29-3)16-21(27)25-13-11-24(12-14-25)18-7-9-19(26)10-8-18/h4-10,26H,11-16H2,1-3H3/p+1