2-[[3-chloranyl-4-(1-thiophen-3-ylcarbonylpiperidin-4-yl)oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-chloranyl-4-(1-thiophen-3-ylcarbonylpiperidin-4-yl)oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-chloro-4-[[1-(thiophene-3-carbonyl)-4-piperidyl]oxy]benzoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-chloro-4-[[1-[oxo(3-thiophenyl)methyl]-4-piperidinyl]oxy]phenyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-chloro-4-[1-(thiophene-3-carbonyl)piperidin-4-yl]oxybenzoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[3-chloro-4-[[1-(3-thenoyl)-4-piperidyl]oxy]benzoyl]amino]ethyl-dimethyl-ammonium Formula: C21H27ClN3O3S+ MolecularWeight: 436.97538

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)C(=O)C3=CSC=C3)Cl

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)C(=O)C3=CSC=C3)Cl

InChI

InChI=1S/C21H26ClN3O3S/c1-24(2)11-8-23-20(26)15-3-4-19(18(22)13-15)28-17-5-9-25(10-6-17)21(27)16-7-12-29-14-16/h3-4,7,12-14,17H,5-6,8-11H2,1-2H3,(H,23,26)/p+1