N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-(2-phenylethanoylamino)propanamide

Systemtic Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-(2-phenylethanoylamino)propanamide Openeye Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-[(2-phenylacetyl)amino]propanamide CAS Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-[(1-oxo-2-phenylethyl)amino]propanamide IUPAC Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-[(2-phenylacetyl)amino]propanamide Traditional Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)phenyl]-3-[(2-phenylacetyl)amino]propionamide Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)NC(=O)CCNC(=O)CC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)NC(=O)CCNC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O6S/c29-24(12-13-26-25(30)16-18-4-2-1-3-5-18)27-19-6-8-20(9-7-19)28-35(31,32)21-10-11-22-23(17-21)34-15-14-33-22/h1-11,17,28H,12-16H2,(H,26,30)(H,27,29)