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

Systemtic Name: 2-[[3-chloranyl-4-(1-pyrazin-2-ylcarbonylpiperidin-4-yl)oxy-phenyl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-chloro-4-[[1-(pyrazine-2-carbonyl)-4-piperidyl]oxy]benzoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-chloro-4-[[1-[oxo(2-pyrazinyl)methyl]-4-piperidinyl]oxy]phenyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-chloro-4-[1-(pyrazine-2-carbonyl)piperidin-4-yl]oxybenzoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[3-chloro-4-[(1-pyrazinoyl-4-piperidyl)oxy]benzoyl]amino]ethyl-dimethyl-ammonium Formula: C21H27ClN5O3+ MolecularWeight: 432.92378

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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=NC=CN=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN5O3/c1-26(2)12-9-25-20(28)15-3-4-19(17(22)13-15)30-16-5-10-27(11-6-16)21(29)18-14-23-7-8-24-18/h3-4,7-8,13-14,16H,5-6,9-12H2,1-2H3,(H,25,28)/p+1