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

Systemtic Name: N-(cyclopentylcarbamoyl)-2-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(cyclopentylcarbamoyl)-2-[4-[(5-fluoro-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-[(cyclopentylamino)-oxomethyl]-2-[4-[(5-fluoro-2-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(cyclopentylcarbamoyl)-2-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(cyclopentylcarbamoyl)-2-[4-(5-fluoro-2-methoxy-benzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C20H31FN4O3+2 MolecularWeight: 394.483543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)C[NH+]2CC[NH+](CC2)CC(=O)NC(=O)NC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)F)C[NH+]2CC[NH+](CC2)CC(=O)NC(=O)NC3CCCC3

InChI

InChI=1S/C20H29FN4O3/c1-28-18-7-6-16(21)12-15(18)13-24-8-10-25(11-9-24)14-19(26)23-20(27)22-17-4-2-3-5-17/h6-7,12,17H,2-5,8-11,13-14H2,1H3,(H2,22,23,26,27)/p+2