2-[[3-chloranyl-4-[1-(cyclopenten-1-ylcarbonyl)piperidin-4-yl]oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-chloranyl-4-[1-(cyclopenten-1-ylcarbonyl)piperidin-4-yl]oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-chloro-4-[[1-(cyclopentene-1-carbonyl)-4-piperidyl]oxy]benzoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-chloro-4-[[1-[1-cyclopentenyl(oxo)methyl]-4-piperidinyl]oxy]phenyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-chloro-4-[1-(cyclopentene-1-carbonyl)piperidin-4-yl]oxybenzoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[3-chloro-4-[[1-(cyclopentene-1-carbonyl)-4-piperidyl]oxy]benzoyl]amino]ethyl-dimethyl-ammonium Formula: C22H31ClN3O3+ MolecularWeight: 420.95284

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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=CCCC3)Cl

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)C(=O)C3=CCCC3)Cl

InChI

InChI=1S/C22H30ClN3O3/c1-25(2)14-11-24-21(27)17-7-8-20(19(23)15-17)29-18-9-12-26(13-10-18)22(28)16-5-3-4-6-16/h5,7-8,15,18H,3-4,6,9-14H2,1-2H3,(H,24,27)/p+1