4-fluoranyl-N-[1-[(3R)-1-(5-methyl-1,2-oxazol-3-yl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperidin-1-ium-4-yl]benzamide

Systemtic Name: 4-fluoranyl-N-[1-[(3R)-1-(5-methyl-1,2-oxazol-3-yl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperidin-1-ium-4-yl]benzamide Openeye Name: 4-fluoro-N-[1-[(3R)-1-(5-methylisoxazol-3-yl)-2,5-dioxo-pyrrolidin-3-yl]piperidin-1-ium-4-yl]benzamide CAS Name: 4-fluoro-N-[1-[(3R)-1-(5-methyl-3-isoxazolyl)-2,5-dioxo-3-pyrrolidinyl]-4-piperidin-1-iumyl]benzamide IUPAC Name: 4-fluoro-N-[1-[(3R)-1-(5-methyl-1,2-oxazol-3-yl)-2,5-dioxopyrrolidin-3-yl]piperidin-1-ium-4-yl]benzamide Traditional Name: N-[1-[(3R)-2,5-diketo-1-(5-methylisoxazol-3-yl)pyrrolidin-3-yl]piperidin-1-ium-4-yl]-4-fluoro-benzamide Formula: C20H22FN4O4+ MolecularWeight: 401.411483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)N2C(=O)CC(C2=O)[NH+]3CCC(CC3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=NO1)N2C(=O)C[C@H](C2=O)[NH+]3CCC(CC3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H21FN4O4/c1-12-10-17(23-29-12)25-18(26)11-16(20(25)28)24-8-6-15(7-9-24)22-19(27)13-2-4-14(21)5-3-13/h2-5,10,15-16H,6-9,11H2,1H3,(H,22,27)/p+1/t16-/m1/s1