2-[4-[(7-chloranyl-3-methyl-1-benzofuran-2-yl)carbonyl]piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-[(7-chloranyl-3-methyl-1-benzofuran-2-yl)carbonyl]piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[4-(7-chloro-3-methyl-benzofuran-2-carbonyl)piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[4-[(7-chloro-3-methyl-2-benzofuranyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[4-(7-chloro-3-methyl-1-benzofuran-2-carbonyl)piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[4-(7-chloro-3-methyl-benzofuran-2-carbonyl)piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)acetamide Formula: C24H27ClN3O3+ MolecularWeight: 440.94248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=C(C4=C(O3)C(=CC=C4)Cl)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=C(C4=C(O3)C(=CC=C4)Cl)C

InChI

InChI=1S/C24H26ClN3O3/c1-15-6-4-7-16(2)21(15)26-20(29)14-27-10-12-28(13-11-27)24(30)22-17(3)18-8-5-9-19(25)23(18)31-22/h4-9H,10-14H2,1-3H3,(H,26,29)/p+1