N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-2-[(4-ethoxyphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-2-[(4-ethoxyphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-2-(4-ethoxy-N-methylsulfonyl-anilino)acetamide CAS Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-ethoxy-N-methylsulfonylanilino)acetamide IUPAC Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-ethoxy-N-methylsulfonylanilino)acetamide Traditional Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-2-(4-ethoxy-N-mesyl-anilino)acetamide Formula: C19H20BrN3O6S MolecularWeight: 498.3476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)NN=CC2=CC3=C(C=C2Br)OCO3)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)N/N=C/C2=CC3=C(C=C2Br)OCO3)S(=O)(=O)C

InChI

InChI=1S/C19H20BrN3O6S/c1-3-27-15-6-4-14(5-7-15)23(30(2,25)26)11-19(24)22-21-10-13-8-17-18(9-16(13)20)29-12-28-17/h4-10H,3,11-12H2,1-2H3,(H,22,24)/b21-10+