1-[(4-fluorophenyl)methoxy]-2-(2-methylpropyl)-4-(phenylcarbonyl)-N-propan-2-yl-piperazin-1-ium-1-carboxamide

Systemtic Name: 1-[(4-fluorophenyl)methoxy]-2-(2-methylpropyl)-4-(phenylcarbonyl)-N-propan-2-yl-piperazin-1-ium-1-carboxamide Openeye Name: 4-benzoyl-1-[(4-fluorophenyl)methoxy]-2-isobutyl-N-isopropyl-piperazin-1-ium-1-carboxamide CAS Name: 4-benzoyl-1-[(4-fluorophenyl)methoxy]-2-(2-methylpropyl)-N-propan-2-yl-1-piperazin-1-iumcarboxamide IUPAC Name: 4-benzoyl-1-[(4-fluorophenyl)methoxy]-2-(2-methylpropyl)-N-propan-2-ylpiperazin-1-ium-1-carboxamide Traditional Name: 4-benzoyl-1-(4-fluorobenzyl)oxy-2-isobutyl-N-isopropyl-piperazin-1-ium-1-carboxamide Formula: C26H35FN3O3+ MolecularWeight: 456.572803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1CN(CC[N+]1(C(=O)NC(C)C)OCC2=CC=C(C=C2)F)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CC1CN(CC[N+]1(C(=O)NC(C)C)OCC2=CC=C(C=C2)F)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H34FN3O3/c1-19(2)16-24-17-29(25(31)22-8-6-5-7-9-22)14-15-30(24,26(32)28-20(3)4)33-18-21-10-12-23(27)13-11-21/h5-13,19-20,24H,14-18H2,1-4H3/p+1