4-(4-fluorophenyl)-N-methyl-4-oxidanylidene-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]butanamide

Systemtic Name: 4-(4-fluorophenyl)-N-methyl-4-oxidanylidene-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]butanamide Openeye Name: 4-(4-fluorophenyl)-N-methyl-4-oxo-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]butanamide CAS Name: 4-(4-fluorophenyl)-N-methyl-4-oxo-N-[(3S)-1-phenethyl-3-piperidin-1-iumyl]butanamide IUPAC Name: 4-(4-fluorophenyl)-N-methyl-4-oxo-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]butanamide Traditional Name: 4-(4-fluorophenyl)-4-keto-N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]butyramide Formula: C24H30FN2O2+ MolecularWeight: 397.505603

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)CCC2=CC=CC=C2)C(=O)CCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)CCC2=CC=CC=C2)C(=O)CCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H29FN2O2/c1-26(24(29)14-13-23(28)20-9-11-21(25)12-10-20)22-8-5-16-27(18-22)17-15-19-6-3-2-4-7-19/h2-4,6-7,9-12,22H,5,8,13-18H2,1H3/p+1/t22-/m0/s1