3-[(3S)-1-(4-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea

Systemtic Name: 3-[(3S)-1-(4-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea Openeye Name: 3-[(3S)-1-(4-fluorophenyl)-5-oxo-pyrrolidin-3-yl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea CAS Name: 3-[(3S)-1-(4-fluorophenyl)-5-oxo-3-pyrrolidinyl]-1-methyl-1-(1-methyl-4-piperidin-1-iumyl)urea IUPAC Name: 3-[(3S)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea Traditional Name: 3-[(3S)-1-(4-fluorophenyl)-5-keto-pyrrolidin-3-yl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea Formula: C18H26FN4O2+ MolecularWeight: 349.423043

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C(=O)NC2CC(=O)N(C2)C3=CC=C(C=C3)F

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C(=O)N[C@H]2CC(=O)N(C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H25FN4O2/c1-21-9-7-15(8-10-21)22(2)18(25)20-14-11-17(24)23(12-14)16-5-3-13(19)4-6-16/h3-6,14-15H,7-12H2,1-2H3,(H,20,25)/p+1/t14-/m0/s1