2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-ium-1-yl]-N-ethyl-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-ium-1-yl]-N-ethyl-N-(2-methylphenyl)ethanamide Openeye Name: N-ethyl-2-(4-indan-5-ylsulfonylpiperazin-1-ium-1-yl)-N-(o-tolyl)acetamide CAS Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazin-1-iumyl]-N-ethyl-N-(2-methylphenyl)acetamide IUPAC Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-ium-1-yl]-N-ethyl-N-(2-methylphenyl)acetamide Traditional Name: N-ethyl-2-(4-indan-5-ylsulfonylpiperazin-1-ium-1-yl)-N-(o-tolyl)acetamide Formula: C24H32N3O3S+ MolecularWeight: 442.59418

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1C)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CCN(C1=CC=CC=C1C)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C24H31N3O3S/c1-3-27(23-10-5-4-7-19(23)2)24(28)18-25-13-15-26(16-14-25)31(29,30)22-12-11-20-8-6-9-21(20)17-22/h4-5,7,10-12,17H,3,6,8-9,13-16,18H2,1-2H3/p+1