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

Systemtic Name: [(2R)-2-(3-ethoxy-4-oxidanyl-phenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethyl]azanium Openeye Name: [(2R)-2-(3-ethoxy-4-hydroxy-phenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethyl]ammonium CAS Name: [(2R)-2-(3-ethoxy-4-hydroxyphenyl)-2-(4-ethyl-1-piperazin-4-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-(3-ethoxy-4-hydroxyphenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethyl]azanium Traditional Name: [(2R)-2-(3-ethoxy-4-hydroxy-phenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethyl]ammonium Formula: C16H29N3O2+2 MolecularWeight: 295.42036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(C[NH3+])C2=CC(=C(C=C2)O)OCC

Isomeric SMILES

CC[NH+]1CCN(CC1)[C@@H](C[NH3+])C2=CC(=C(C=C2)O)OCC

InChI

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