N-[1-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-4-methoxy-benzamide

Systemtic Name: N-[1-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-4-methoxy-benzamide Openeye Name: N-[1-[2-(3-fluoroanilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-4-methoxy-benzamide CAS Name: N-[1-[2-(3-fluoroanilino)-2-oxoethyl]-4-piperidin-1-iumyl]-4-methoxybenzamide IUPAC Name: N-[1-[2-(3-fluoroanilino)-2-oxoethyl]piperidin-1-ium-4-yl]-4-methoxybenzamide Traditional Name: N-[1-[2-(3-fluoroanilino)-2-keto-ethyl]piperidin-1-ium-4-yl]-4-methoxy-benzamide Formula: C21H25FN3O3+ MolecularWeight: 386.439903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C21H24FN3O3/c1-28-19-7-5-15(6-8-19)21(27)24-17-9-11-25(12-10-17)14-20(26)23-18-4-2-3-16(22)13-18/h2-8,13,17H,9-12,14H2,1H3,(H,23,26)(H,24,27)/p+1