[5-(1,3-benzodioxol-5-yl)-3-ethoxy-1,2,4-triazol-1-yl]-(4-bromophenyl)methanone

Systemtic Name: [5-(1,3-benzodioxol-5-yl)-3-ethoxy-1,2,4-triazol-1-yl]-(4-bromophenyl)methanone Openeye Name: [5-(1,3-benzodioxol-5-yl)-3-ethoxy-1,2,4-triazol-1-yl]-(4-bromophenyl)methanone CAS Name: [5-(1,3-benzodioxol-5-yl)-3-ethoxy-1,2,4-triazol-1-yl]-(4-bromophenyl)methanone IUPAC Name: [5-(1,3-benzodioxol-5-yl)-3-ethoxy-1,2,4-triazol-1-yl]-(4-bromophenyl)methanone Traditional Name: [5-(1,3-benzodioxol-5-yl)-3-ethoxy-1,2,4-triazol-1-yl]-(4-bromophenyl)methanone Formula: C18H14BrN3O4 MolecularWeight: 416.22546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=N1)C2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC1=NN(C(=N1)C2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C18H14BrN3O4/c1-2-24-18-20-16(12-5-8-14-15(9-12)26-10-25-14)22(21-18)17(23)11-3-6-13(19)7-4-11/h3-9H,2,10H2,1H3