2-[[3-chloranyl-4-[1-(4-methoxy-4-oxidanylidene-butanoyl)piperidin-4-yl]oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-chloranyl-4-[1-(4-methoxy-4-oxidanylidene-butanoyl)piperidin-4-yl]oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-chloro-4-[[1-(4-methoxy-4-oxo-butanoyl)-4-piperidyl]oxy]benzoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-chloro-4-[[1-(4-methoxy-1,4-dioxobutyl)-4-piperidinyl]oxy]phenyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-chloro-4-[1-(4-methoxy-4-oxobutanoyl)piperidin-4-yl]oxybenzoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[3-chloro-4-[[1-(4-keto-4-methoxy-butanoyl)-4-piperidyl]oxy]benzoyl]amino]ethyl-dimethyl-ammonium Formula: C21H31ClN3O5+ MolecularWeight: 440.94094

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)C(=O)CCC(=O)OC)Cl

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)C(=O)CCC(=O)OC)Cl

InChI

InChI=1S/C21H30ClN3O5/c1-24(2)13-10-23-21(28)15-4-5-18(17(22)14-15)30-16-8-11-25(12-9-16)19(26)6-7-20(27)29-3/h4-5,14,16H,6-13H2,1-3H3,(H,23,28)/p+1