2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoylamino]-N-phenethyl-benzamide

Systemtic Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoylamino]-N-phenethyl-benzamide Openeye Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoylamino]-N-phenethyl-benzamide CAS Name: 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-oxopropyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoylamino]-N-phenethylbenzamide Traditional Name: 2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoylamino]-N-phenethyl-benzamide Formula: C26H26N2O6S MolecularWeight: 494.55944

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)CCC(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)CCC(=O)NC3=CC=CC=C3C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H26N2O6S/c29-25(13-17-35(31,32)20-10-11-23-24(18-20)34-16-15-33-23)28-22-9-5-4-8-21(22)26(30)27-14-12-19-6-2-1-3-7-19/h1-11,18H,12-17H2,(H,27,30)(H,28,29)