3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylphenyl]propanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]propanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]propionamide Formula: C24H32N3O5S+ MolecularWeight: 474.59298

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CCS(=O)(=O)C3=CC4=C(C=C3)OCCO4)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CCS(=O)(=O)C3=CC4=C(C=C3)OCCO4)C

InChI

InChI=1S/C24H31N3O5S/c1-3-26-9-11-27(12-10-26)19-4-6-21(18(2)16-19)25-24(28)8-15-33(29,30)20-5-7-22-23(17-20)32-14-13-31-22/h4-7,16-17H,3,8-15H2,1-2H3,(H,25,28)/p+1