2-(4-chloranyl-2-prop-2-enyl-phenoxy)ethyl-(2-morpholin-4-ium-4-ylethyl)azanium

Systemtic Name: 2-(4-chloranyl-2-prop-2-enyl-phenoxy)ethyl-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: 2-(2-allyl-4-chloro-phenoxy)ethyl-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: 2-(4-chloro-2-prop-2-enylphenoxy)ethyl-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: 2-(4-chloro-2-prop-2-enylphenoxy)ethyl-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: 2-(2-allyl-4-chloro-phenoxy)ethyl-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C17H27ClN2O2+2 MolecularWeight: 326.86148

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=CC(=C1)Cl)OCC[NH2+]CC[NH+]2CCOCC2

Isomeric SMILES

C=CCC1=C(C=CC(=C1)Cl)OCC[NH2+]CC[NH+]2CCOCC2

InChI

InChI=1S/C17H25ClN2O2/c1-2-3-15-14-16(18)4-5-17(15)22-11-7-19-6-8-20-9-12-21-13-10-20/h2,4-5,14,19H,1,3,6-13H2/p+2