2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-N-[4-(cyanomethyl)phenyl]ethanamide

Systemtic Name: 2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-N-[4-(cyanomethyl)phenyl]ethanamide Openeye Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-N-[4-(cyanomethyl)phenyl]acetamide CAS Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-N-[4-(cyanomethyl)phenyl]acetamide IUPAC Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-N-[4-(cyanomethyl)phenyl]acetamide Traditional Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)amino]-N-[4-(cyanomethyl)phenyl]acetamide Formula: C18H16BrN3O3 MolecularWeight: 402.24194

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)NCC(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)NCC(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C18H16BrN3O3/c19-14-9-16-17(25-8-7-24-16)10-15(14)21-11-18(23)22-13-3-1-12(2-4-13)5-6-20/h1-4,9-10,21H,5,7-8,11H2,(H,22,23)