4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-N,N-dimethyl-pyridine-2-carboxamide

Systemtic Name: 4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-N,N-dimethyl-pyridine-2-carboxamide Openeye Name: 4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-N,N-dimethyl-pyridine-2-carboxamide CAS Name: 4-[4-[2-(4-methoxyphenoxy)ethyl]-1-piperazin-4-iumyl]-N,N-dimethyl-2-pyridinecarboxamide IUPAC Name: 4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-N,N-dimethylpyridine-2-carboxamide Traditional Name: 4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-N,N-dimethyl-picolinamide Formula: C21H29N4O3+ MolecularWeight: 385.47996

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=NC=CC(=C1)N2CC[NH+](CC2)CCOC3=CC=C(C=C3)OC

Isomeric SMILES

CN(C)C(=O)C1=NC=CC(=C1)N2CC[NH+](CC2)CCOC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H28N4O3/c1-23(2)21(26)20-16-17(8-9-22-20)25-12-10-24(11-13-25)14-15-28-19-6-4-18(27-3)5-7-19/h4-9,16H,10-15H2,1-3H3/p+1