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

Systemtic Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(3-phenylpropyl)propanamide Openeye Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(3-phenylpropyl)propanamide CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(3-phenylpropyl)propanamide IUPAC Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(3-phenylpropyl)propanamide Traditional Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(mesyl)amino]-N-(3-phenylpropyl)propionamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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