(2R)-2-acetamido-N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-methyl-butanamide

Systemtic Name: (2R)-2-acetamido-N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-methyl-butanamide Openeye Name: (2R)-2-acetamido-N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-methyl-butanamide CAS Name: (2R)-2-acetamido-N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-methylbutanamide IUPAC Name: (2R)-2-acetamido-N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-methylbutanamide Traditional Name: (2R)-2-acetamido-N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-methyl-butyramide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3)NC(=O)C

Isomeric SMILES

CC(C)[C@H](C(=O)NC1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3)NC(=O)C

InChI

InChI=1S/C21H25N3O6S/c1-13(2)20(22-14(3)25)21(26)23-15-4-6-16(7-5-15)24-31(27,28)17-8-9-18-19(12-17)30-11-10-29-18/h4-9,12-13,20,24H,10-11H2,1-3H3,(H,22,25)(H,23,26)/t20-/m1/s1