2-[4-[(1R)-2-azaniumyl-1-[methyl(phenyl)amino]ethyl]phenoxy]ethyl-dimethyl-azanium

Systemtic Name: 2-[4-[(1R)-2-azaniumyl-1-[methyl(phenyl)amino]ethyl]phenoxy]ethyl-dimethyl-azanium Openeye Name: 2-[4-[(1R)-2-azaniumyl-1-(N-methylanilino)ethyl]phenoxy]ethyl-dimethyl-ammonium CAS Name: 2-[4-[(1R)-2-ammonio-1-(N-methylanilino)ethyl]phenoxy]ethyl-dimethylammonium IUPAC Name: 2-[4-[(1R)-2-azaniumyl-1-(N-methylanilino)ethyl]phenoxy]ethyl-dimethylazanium Traditional Name: 2-[4-[(1R)-2-ammonio-1-(N-methylanilino)ethyl]phenoxy]ethyl-dimethyl-ammonium Formula: C19H29N3O+2 MolecularWeight: 315.45306

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC1=CC=C(C=C1)C(C[NH3+])N(C)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)CCOC1=CC=C(C=C1)[C@H](C[NH3+])N(C)C2=CC=CC=C2

InChI

InChI=1S/C19H27N3O/c1-21(2)13-14-23-18-11-9-16(10-12-18)19(15-20)22(3)17-7-5-4-6-8-17/h4-12,19H,13-15,20H2,1-3H3/p+2/t19-/m0/s1