N-butyl-2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(4-methylphenyl)amino]ethanamide

Systemtic Name: N-butyl-2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(4-methylphenyl)amino]ethanamide Openeye Name: N-butyl-2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methyl-anilino]acetamide CAS Name: N-butyl-2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methylanilino]acetamide IUPAC Name: N-butyl-2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methylanilino]acetamide Traditional Name: N-butyl-2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methyl-anilino]acetamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN(C1=CC=C(C=C1)C)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCCCNC(=O)CN(C1=CC=C(C=C1)C)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H26N2O5S/c1-3-4-11-22-21(24)15-23(17-7-5-16(2)6-8-17)29(25,26)18-9-10-19-20(14-18)28-13-12-27-19/h5-10,14H,3-4,11-13,15H2,1-2H3,(H,22,24)