2-[[3-methoxy-4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]methylazaniumyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-methoxy-4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]methylazaniumyl]ethyl-dimethyl-azanium Openeye Name: 2-[[3-methoxy-4-[2-oxo-2-(1-piperidyl)ethoxy]phenyl]methylammonio]ethyl-dimethyl-ammonium CAS Name: 2-[[3-methoxy-4-[2-oxo-2-(1-piperidinyl)ethoxy]phenyl]methylammonio]ethyl-dimethylammonium IUPAC Name: 2-[[3-methoxy-4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]methylazaniumyl]ethyl-dimethylazanium Traditional Name: 2-[[4-(2-keto-2-piperidino-ethoxy)-3-methoxy-benzyl]ammonio]ethyl-dimethyl-ammonium Formula: C19H33N3O3+2 MolecularWeight: 351.48362

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC[NH2+]CC1=CC(=C(C=C1)OCC(=O)N2CCCCC2)OC

Isomeric SMILES

C[NH+](C)CC[NH2+]CC1=CC(=C(C=C1)OCC(=O)N2CCCCC2)OC

InChI

InChI=1S/C19H31N3O3/c1-21(2)12-9-20-14-16-7-8-17(18(13-16)24-3)25-15-19(23)22-10-5-4-6-11-22/h7-8,13,20H,4-6,9-12,14-15H2,1-3H3/p+2