(3R)-N-[(5-acetamido-1-methyl-benzimidazol-2-yl)methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-[(5-acetamido-1-methyl-benzimidazol-2-yl)methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-[(5-acetamido-1-methyl-benzimidazol-2-yl)methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-[(5-acetamido-1-methyl-2-benzimidazolyl)methyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-[(5-acetamido-1-methylbenzimidazol-2-yl)methyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-[(5-acetamido-1-methyl-benzimidazol-2-yl)methyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C20H20N4O4 MolecularWeight: 380.3972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(=N2)CNC(=O)C3COC4=CC=CC=C4O3)C

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(=N2)CNC(=O)[C@H]3COC4=CC=CC=C4O3)C

InChI

InChI=1S/C20H20N4O4/c1-12(25)22-13-7-8-15-14(9-13)23-19(24(15)2)10-21-20(26)18-11-27-16-5-3-4-6-17(16)28-18/h3-9,18H,10-11H2,1-2H3,(H,21,26)(H,22,25)/t18-/m1/s1