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

Systemtic Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-ium-1-yl]-N-ethyl-N-phenyl-ethanamide Openeye Name: N-ethyl-2-(4-indan-5-ylsulfonylpiperazin-1-ium-1-yl)-N-phenyl-acetamide CAS Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazin-1-iumyl]-N-ethyl-N-phenylacetamide IUPAC Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-ium-1-yl]-N-ethyl-N-phenylacetamide Traditional Name: N-ethyl-2-(4-indan-5-ylsulfonylpiperazin-1-ium-1-yl)-N-phenyl-acetamide Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O3S/c1-2-26(21-9-4-3-5-10-21)23(27)18-24-13-15-25(16-14-24)30(28,29)22-12-11-19-7-6-8-20(19)17-22/h3-5,9-12,17H,2,6-8,13-16,18H2,1H3/p+1