N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[(3,4-dimethoxyphenyl)methyl]-N-ethylacetamide Traditional Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-ethyl-N-veratryl-acetamide Formula: C24H35N3O3+2 MolecularWeight: 413.553

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)OC)C(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)OC)C(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H33N3O3/c1-4-27(18-21-10-11-22(29-2)23(16-21)30-3)24(28)19-26-14-12-25(13-15-26)17-20-8-6-5-7-9-20/h5-11,16H,4,12-15,17-19H2,1-3H3/p+2