2-[2-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanoylamino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanoylamino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[2-[4-[(5-fluoro-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]acetyl]amino]-N-isopropyl-acetamide CAS Name: 2-[[2-[4-[(5-fluoro-2-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]-1-oxoethyl]amino]-N-propan-2-ylacetamide IUPAC Name: 2-[[2-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetyl]amino]-N-propan-2-ylacetamide Traditional Name: 2-[[2-[4-(5-fluoro-2-methoxy-benzyl)piperazine-1,4-diium-1-yl]acetyl]amino]-N-isopropyl-acetamide Formula: C19H31FN4O3+2 MolecularWeight: 382.472843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)C[NH+]1CC[NH+](CC1)CC2=C(C=CC(=C2)F)OC

Isomeric SMILES

CC(C)NC(=O)CNC(=O)C[NH+]1CC[NH+](CC1)CC2=C(C=CC(=C2)F)OC

InChI

InChI=1S/C19H29FN4O3/c1-14(2)22-18(25)11-21-19(26)13-24-8-6-23(7-9-24)12-15-10-16(20)4-5-17(15)27-3/h4-5,10,14H,6-9,11-13H2,1-3H3,(H,21,26)(H,22,25)/p+2