2,6-dimethoxy-N-(3-piperazin-4-ium-1-ylpropyl)benzamide

Systemtic Name: 2,6-dimethoxy-N-(3-piperazin-4-ium-1-ylpropyl)benzamide Openeye Name: 2,6-dimethoxy-N-(3-piperazin-4-ium-1-ylpropyl)benzamide CAS Name: 2,6-dimethoxy-N-[3-(1-piperazin-4-iumyl)propyl]benzamide IUPAC Name: 2,6-dimethoxy-N-(3-piperazin-4-ium-1-ylpropyl)benzamide Traditional Name: 2,6-dimethoxy-N-(3-piperazin-4-ium-1-ylpropyl)benzamide Formula: C16H26N3O3+ MolecularWeight: 308.39594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)NCCCN2CC[NH2+]CC2

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)NCCCN2CC[NH2+]CC2

InChI

InChI=1S/C16H25N3O3/c1-21-13-5-3-6-14(22-2)15(13)16(20)18-7-4-10-19-11-8-17-9-12-19/h3,5-6,17H,4,7-12H2,1-2H3,(H,18,20)/p+1