N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(oxolan-2-ylmethylamino)ethanamide; ethanedioic acid

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(oxolan-2-ylmethylamino)ethanamide; ethanedioic acid Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(tetrahydrofuran-2-ylmethylamino)acetamide; oxalic acid CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-(2-oxolanylmethylamino)acetamide; oxalic acid IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(oxolan-2-ylmethylamino)acetamide; oxalic acid Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(tetrahydrofurfurylamino)acetamide; oxalic acid Formula: C18H23N3O9 MolecularWeight: 425.38992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNCC(=O)NC(=O)NC2=CC3=C(C=C2)OCCO3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC(OC1)CNCC(=O)NC(=O)NC2=CC3=C(C=C2)OCCO3.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H21N3O5.C2H2O4/c20-15(10-17-9-12-2-1-5-22-12)19-16(21)18-11-3-4-13-14(8-11)24-7-6-23-13;3-1(4)2(5)6/h3-4,8,12,17H,1-2,5-7,9-10H2,(H2,18,19,20,21);(H,3,4)(H,5,6)