1-[3-[(2-fluorophenyl)amino]-3-oxidanylidene-propyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[3-[(2-fluorophenyl)amino]-3-oxidanylidene-propyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-1-[3-(2-fluoroanilino)-3-oxo-propyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[3-(2-fluoroanilino)-3-oxopropyl]-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-1-[3-(2-fluoroanilino)-3-oxopropyl]piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-1-[3-(2-fluoroanilino)-3-keto-propyl]piperidin-1-ium-4-carboxamide Formula: C22H27FN3O2+ MolecularWeight: 384.467083

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCC2=CC=CC=C2)CCC(=O)NC3=CC=CC=C3F

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCC2=CC=CC=C2)CCC(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C22H26FN3O2/c23-19-8-4-5-9-20(19)25-21(27)12-15-26-13-10-18(11-14-26)22(28)24-16-17-6-2-1-3-7-17/h1-9,18H,10-16H2,(H,24,28)(H,25,27)/p+1