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

Systemtic Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(4-methylphenyl)amino]-N-pentan-3-yl-ethanamide Openeye Name: 2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methyl-anilino]-N-(1-ethylpropyl)acetamide CAS Name: 2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methylanilino]-N-pentan-3-ylacetamide IUPAC Name: 2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methylanilino]-N-pentan-3-ylacetamide Traditional Name: 2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methyl-anilino]-N-(1-ethylpropyl)acetamide Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O5S/c1-4-17(5-2)23-22(25)15-24(18-8-6-16(3)7-9-18)30(26,27)19-10-11-20-21(14-19)29-13-12-28-20/h6-11,14,17H,4-5,12-13,15H2,1-3H3,(H,23,25)