N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-[(1R)-3-oxidanylidene-1H-2-benzofuran-1-yl]ethanamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-[(1R)-3-oxidanylidene-1H-2-benzofuran-1-yl]ethanamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-[(1R)-3-oxo-1H-isobenzofuran-1-yl]acetamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-[(1R)-3-oxo-1H-isobenzofuran-1-yl]acetamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-[(1R)-3-ketophthalan-1-yl]acetamide Formula: C21H23ClN3O3+ MolecularWeight: 400.87862

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CC3C4=CC=CC=C4C(=O)O3

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C[C@@H]3C4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C21H22ClN3O3/c1-24-8-10-25(11-9-24)18-7-6-14(22)12-17(18)23-20(26)13-19-15-4-2-3-5-16(15)21(27)28-19/h2-7,12,19H,8-11,13H2,1H3,(H,23,26)/p+1/t19-/m1/s1