[(cyanoamino)-[(4-fluorophenyl)carbonyl-(4-oxidanylpiperidin-1-yl)amino]methylidene]-methyl-propyl-azanium

Systemtic Name: [(cyanoamino)-[(4-fluorophenyl)carbonyl-(4-oxidanylpiperidin-1-yl)amino]methylidene]-methyl-propyl-azanium Openeye Name: [(cyanoamino)-[(4-fluorobenzoyl)-(4-hydroxy-1-piperidyl)amino]methylene]-methyl-propyl-ammonium CAS Name: [(cyanoamino)-[[(4-fluorophenyl)-oxomethyl]-(4-hydroxy-1-piperidinyl)amino]methylidene]-methyl-propylammonium IUPAC Name: [(cyanoamino)-[(4-fluorobenzoyl)-(4-hydroxypiperidin-1-yl)amino]methylidene]-methyl-propylazanium Traditional Name: [(cyanoamino)-[(4-fluorobenzoyl)-(4-hydroxypiperidino)amino]methylene]-methyl-propyl-ammonium Formula: C18H25FN5O2+ MolecularWeight: 362.421803

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](=C(NC#N)N(C(=O)C1=CC=C(C=C1)F)N2CCC(CC2)O)C

Isomeric SMILES

CCC[N+](=C(NC#N)N(C(=O)C1=CC=C(C=C1)F)N2CCC(CC2)O)C

InChI

InChI=1S/C18H24FN5O2/c1-3-10-22(2)18(21-13-20)24(23-11-8-16(25)9-12-23)17(26)14-4-6-15(19)7-5-14/h4-7,16,25H,3,8-12H2,1-2H3/p+1