3-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium-1-yl]propanamide

Systemtic Name: 3-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium-1-yl]propanamide Openeye Name: 3-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium-1-yl]propanamide CAS Name: 3-[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: 3-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium-1-yl]propanamide Traditional Name: 3-[4-(2,3,4-trimethoxybenzyl)piperazin-1-ium-1-yl]propionamide Formula: C17H28N3O4+ MolecularWeight: 338.42192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CC[NH+](CC2)CCC(=O)N)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CC[NH+](CC2)CCC(=O)N)OC)OC

InChI

InChI=1S/C17H27N3O4/c1-22-14-5-4-13(16(23-2)17(14)24-3)12-20-10-8-19(9-11-20)7-6-15(18)21/h4-5H,6-12H2,1-3H3,(H2,18,21)/p+1