2-[4-chloranyl-2-(phenylmethyl)phenoxy]ethyl-(2-morpholin-4-ium-4-ylethyl)azanium

Systemtic Name: 2-[4-chloranyl-2-(phenylmethyl)phenoxy]ethyl-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: 2-(2-benzyl-4-chloro-phenoxy)ethyl-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: 2-[4-chloro-2-(phenylmethyl)phenoxy]ethyl-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: 2-(2-benzyl-4-chlorophenoxy)ethyl-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: 2-(2-benzyl-4-chloro-phenoxy)ethyl-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C21H29ClN2O2+2 MolecularWeight: 376.92016

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC[NH2+]CCOC2=C(C=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CC[NH2+]CCOC2=C(C=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C21H27ClN2O2/c22-20-6-7-21(19(17-20)16-18-4-2-1-3-5-18)26-13-9-23-8-10-24-11-14-25-15-12-24/h1-7,17,23H,8-16H2/p+2