N-[[1-(N'-cyanocarbamimidoyl)-4-(2-fluorophenyl)piperidin-4-yl]methyl]-2-methoxy-6-oxidanyl-benzamide

Systemtic Name: N-[[1-(N'-cyanocarbamimidoyl)-4-(2-fluorophenyl)piperidin-4-yl]methyl]-2-methoxy-6-oxidanyl-benzamide Openeye Name: N-[[1-(N'-cyanocarbamimidoyl)-4-(2-fluorophenyl)-4-piperidyl]methyl]-2-hydroxy-6-methoxy-benzamide CAS Name: N-[[1-[amino(cyanoimino)methyl]-4-(2-fluorophenyl)-4-piperidinyl]methyl]-2-hydroxy-6-methoxybenzamide IUPAC Name: N-[[1-(N'-cyanocarbamimidoyl)-4-(2-fluorophenyl)piperidin-4-yl]methyl]-2-hydroxy-6-methoxybenzamide Traditional Name: N-[[1-(N'-cyanoamidino)-4-(2-fluorophenyl)-4-piperidyl]methyl]-2-hydroxy-6-methoxy-benzamide Formula: C22H24FN5O3 MolecularWeight: 425.456063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1C(=O)NCC2(CCN(CC2)C(=NC#N)N)C3=CC=CC=C3F)O

Isomeric SMILES

COC1=CC=CC(=C1C(=O)NCC2(CCN(CC2)C(=NC#N)N)C3=CC=CC=C3F)O

InChI

InChI=1S/C22H24FN5O3/c1-31-18-8-4-7-17(29)19(18)20(30)26-13-22(15-5-2-3-6-16(15)23)9-11-28(12-10-22)21(25)27-14-24/h2-8,29H,9-13H2,1H3,(H2,25,27)(H,26,30)