2-[4-[(3-chloranyl-5-methyl-1H-indol-2-yl)carbonyl]piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-[(3-chloranyl-5-methyl-1H-indol-2-yl)carbonyl]piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[4-(3-chloro-5-methyl-1H-indole-2-carbonyl)piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[4-[(3-chloro-5-methyl-1H-indol-2-yl)-oxomethyl]-1-piperazin-1-iumyl]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[4-(3-chloro-5-methyl-1H-indole-2-carbonyl)piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[4-(3-chloro-5-methyl-1H-indole-2-carbonyl)piperazin-1-ium-1-yl]-N-(2,6-dimethylphenyl)acetamide Formula: C24H28ClN4O2+ MolecularWeight: 439.95772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2Cl)C(=O)N3CC[NH+](CC3)CC(=O)NC4=C(C=CC=C4C)C

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2Cl)C(=O)N3CC[NH+](CC3)CC(=O)NC4=C(C=CC=C4C)C

InChI

InChI=1S/C24H27ClN4O2/c1-15-7-8-19-18(13-15)21(25)23(26-19)24(31)29-11-9-28(10-12-29)14-20(30)27-22-16(2)5-4-6-17(22)3/h4-8,13,26H,9-12,14H2,1-3H3,(H,27,30)/p+1