2-(2-methoxy-6-piperazin-4-ium-1-ylcarbonyl-phenoxy)ethyl-dimethyl-azanium

Systemtic Name: 2-(2-methoxy-6-piperazin-4-ium-1-ylcarbonyl-phenoxy)ethyl-dimethyl-azanium Openeye Name: 2-[2-methoxy-6-(piperazin-4-ium-1-carbonyl)phenoxy]ethyl-dimethyl-ammonium CAS Name: 2-[2-methoxy-6-[oxo(1-piperazin-4-iumyl)methyl]phenoxy]ethyl-dimethylammonium IUPAC Name: 2-[2-methoxy-6-(piperazin-4-ium-1-carbonyl)phenoxy]ethyl-dimethylazanium Traditional Name: 2-[2-methoxy-6-(piperazin-4-ium-1-carbonyl)phenoxy]ethyl-dimethyl-ammonium Formula: C16H27N3O3+2 MolecularWeight: 309.40388

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC1=C(C=CC=C1OC)C(=O)N2CC[NH2+]CC2

Isomeric SMILES

C[NH+](C)CCOC1=C(C=CC=C1OC)C(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C16H25N3O3/c1-18(2)11-12-22-15-13(5-4-6-14(15)21-3)16(20)19-9-7-17-8-10-19/h4-6,17H,7-12H2,1-3H3/p+2