[4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-ethoxy-phenyl]methyl-(1-ethanoylpiperidin-4-yl)azanium

Systemtic Name: [4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-ethoxy-phenyl]methyl-(1-ethanoylpiperidin-4-yl)azanium Openeye Name: (1-acetyl-4-piperidyl)-[[4-[(2-chloro-6-fluoro-phenyl)methoxy]-3-ethoxy-phenyl]methyl]ammonium CAS Name: (1-acetyl-4-piperidinyl)-[[4-[(2-chloro-6-fluorophenyl)methoxy]-3-ethoxyphenyl]methyl]ammonium IUPAC Name: (1-acetylpiperidin-4-yl)-[[4-[(2-chloro-6-fluorophenyl)methoxy]-3-ethoxyphenyl]methyl]azanium Traditional Name: (1-acetyl-4-piperidyl)-[4-(2-chloro-6-fluoro-benzyl)oxy-3-ethoxy-benzyl]ammonium Formula: C23H29ClFN2O3+ MolecularWeight: 435.939363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C2CCN(CC2)C(=O)C)OCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]C2CCN(CC2)C(=O)C)OCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C23H28ClFN2O3/c1-3-29-23-13-17(14-26-18-9-11-27(12-10-18)16(2)28)7-8-22(23)30-15-19-20(24)5-4-6-21(19)25/h4-8,13,18,26H,3,9-12,14-15H2,1-2H3/p+1