2-[2,3-dihydro-1,4-benzodioxin-6-yl(ethylsulfonyl)amino]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(ethylsulfonyl)amino]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(ethylsulfonyl)amino]-N-(3-phenylpropyl)acetamide CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(ethylsulfonyl)amino]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(ethylsulfonyl)amino]-N-(3-phenylpropyl)acetamide Traditional Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(esyl)amino]-N-(3-phenylpropyl)acetamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(CC(=O)NCCCC1=CC=CC=C1)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCS(=O)(=O)N(CC(=O)NCCCC1=CC=CC=C1)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H26N2O5S/c1-2-29(25,26)23(18-10-11-19-20(15-18)28-14-13-27-19)16-21(24)22-12-6-9-17-7-4-3-5-8-17/h3-5,7-8,10-11,15H,2,6,9,12-14,16H2,1H3,(H,22,24)