2-[4-[[4-(3-methylbutoxy)phenyl]methyl]piperazine-1,4-diium-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[[4-(3-methylbutoxy)phenyl]methyl]piperazine-1,4-diium-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-[(4-isopentyloxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[[4-(3-methylbutoxy)phenyl]methyl]-1-piperazine-1,4-diiumyl]-N-propylacetamide IUPAC Name: 2-[4-[[4-(3-methylbutoxy)phenyl]methyl]piperazine-1,4-diium-1-yl]-N-propylacetamide Traditional Name: 2-[4-(4-isoamoxybenzyl)piperazine-1,4-diium-1-yl]-N-propyl-acetamide Formula: C21H37N3O2+2 MolecularWeight: 363.53738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H35N3O2/c1-4-10-22-21(25)17-24-13-11-23(12-14-24)16-19-5-7-20(8-6-19)26-15-9-18(2)3/h5-8,18H,4,9-17H2,1-3H3,(H,22,25)/p+2