(2-chloranyl-6-fluoranyl-phenyl)methyl-cyclopropyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl-cyclopropyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (2-chloro-6-fluoro-phenyl)methyl-cyclopropyl-[2-[(1-ethoxycarbonyl-4-piperidyl)amino]-2-oxo-ethyl]ammonium CAS Name: (2-chloro-6-fluorophenyl)methyl-cyclopropyl-[2-[(1-ethoxycarbonyl-4-piperidinyl)amino]-2-oxoethyl]ammonium IUPAC Name: (2-chloro-6-fluorophenyl)methyl-cyclopropyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxoethyl]azanium Traditional Name: [2-[(1-carbethoxy-4-piperidyl)amino]-2-keto-ethyl]-(2-chloro-6-fluoro-benzyl)-cyclopropyl-ammonium Formula: C20H28ClFN3O3+ MolecularWeight: 412.906023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+](CC2=C(C=CC=C2Cl)F)C3CC3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+](CC2=C(C=CC=C2Cl)F)C3CC3

InChI

InChI=1S/C20H27ClFN3O3/c1-2-28-20(27)24-10-8-14(9-11-24)23-19(26)13-25(15-6-7-15)12-16-17(21)4-3-5-18(16)22/h3-5,14-15H,2,6-13H2,1H3,(H,23,26)/p+1