N-[(3S)-1-(3-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-[(3S)-1-(3-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-[(3S)-1-(3-fluorophenyl)-5-oxo-pyrrolidin-3-yl]-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide CAS Name: N-[(3S)-1-(3-fluorophenyl)-5-oxo-3-pyrrolidinyl]-4-(2-hydroxyethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-[(3S)-1-(3-fluorophenyl)-5-keto-pyrrolidin-3-yl]-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide Formula: C17H24FN4O3+ MolecularWeight: 351.395863

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C(=O)NC2CC(=O)N(C2)C3=CC(=CC=C3)F

Isomeric SMILES

C1CN(CC[NH+]1CCO)C(=O)N[C@H]2CC(=O)N(C2)C3=CC(=CC=C3)F

InChI

InChI=1S/C17H23FN4O3/c18-13-2-1-3-15(10-13)22-12-14(11-16(22)24)19-17(25)21-6-4-20(5-7-21)8-9-23/h1-3,10,14,23H,4-9,11-12H2,(H,19,25)/p+1/t14-/m0/s1