2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[(4-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-propylacetamide IUPAC Name: 2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-propylacetamide Traditional Name: 2-(4-p-anisylpiperazine-1,4-diium-1-yl)-N-propyl-acetamide Formula: C17H29N3O2+2 MolecularWeight: 307.43106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCNC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H27N3O2/c1-3-8-18-17(21)14-20-11-9-19(10-12-20)13-15-4-6-16(22-2)7-5-15/h4-7H,3,8-14H2,1-2H3,(H,18,21)/p+2