[(2R)-2-(2-ethoxy-3-methoxy-phenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium

Systemtic Name: [(2R)-2-(2-ethoxy-3-methoxy-phenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium Openeye Name: [(2R)-2-(2-ethoxy-3-methoxy-phenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]ammonium CAS Name: [(2R)-2-(2-ethoxy-3-methoxyphenyl)-2-(4-methyl-1-piperazin-4-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-(2-ethoxy-3-methoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium Traditional Name: [(2R)-2-(2-ethoxy-3-methoxy-phenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]ammonium Formula: C16H29N3O2+2 MolecularWeight: 295.42036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=C1OC)C(C[NH3+])N2CC[NH+](CC2)C

Isomeric SMILES

CCOC1=C(C=CC=C1OC)[C@H](C[NH3+])N2CC[NH+](CC2)C

InChI

InChI=1S/C16H27N3O2/c1-4-21-16-13(6-5-7-15(16)20-3)14(12-17)19-10-8-18(2)9-11-19/h5-7,14H,4,8-12,17H2,1-3H3/p+2/t14-/m0/s1