2-[[3-chloranyl-4-[1-(5-methoxyfuran-2-yl)carbonylpiperidin-4-yl]oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-chloranyl-4-[1-(5-methoxyfuran-2-yl)carbonylpiperidin-4-yl]oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-chloro-4-[[1-(5-methoxyfuran-2-carbonyl)-4-piperidyl]oxy]benzoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-chloro-4-[[1-[(5-methoxy-2-furanyl)-oxomethyl]-4-piperidinyl]oxy]phenyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-chloro-4-[1-(5-methoxyfuran-2-carbonyl)piperidin-4-yl]oxybenzoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[3-chloro-4-[[1-(5-methoxy-2-furoyl)-4-piperidyl]oxy]benzoyl]amino]ethyl-dimethyl-ammonium Formula: C22H29ClN3O5+ MolecularWeight: 450.93576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)C(=O)C3=CC=C(O3)OC)Cl

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC(=C(C=C1)OC2CCN(CC2)C(=O)C3=CC=C(O3)OC)Cl

InChI

InChI=1S/C22H28ClN3O5/c1-25(2)13-10-24-21(27)15-4-5-18(17(23)14-15)30-16-8-11-26(12-9-16)22(28)19-6-7-20(29-3)31-19/h4-7,14,16H,8-13H2,1-3H3,(H,24,27)/p+1