(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(4-bromanyl-3-methyl-phenyl)-1,3-oxazol-5-one

Systemtic Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(4-bromanyl-3-methyl-phenyl)-1,3-oxazol-5-one Openeye Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylene)-2-(4-bromo-3-methyl-phenyl)oxazol-5-one CAS Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(4-bromo-3-methylphenyl)-5-oxazolone IUPAC Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(4-bromo-3-methylphenyl)-1,3-oxazol-5-one Traditional Name: (4Z)-2-(4-bromo-3-methyl-phenyl)-4-piperonylidene-2-oxazolin-5-one Formula: C18H12BrNO4 MolecularWeight: 386.19618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC(=CC3=CC4=C(C=C3)OCO4)C(=O)O2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C2=N/C(=C\C3=CC4=C(C=C3)OCO4)/C(=O)O2)Br

InChI

InChI=1S/C18H12BrNO4/c1-10-6-12(3-4-13(10)19)17-20-14(18(21)24-17)7-11-2-5-15-16(8-11)23-9-22-15/h2-8H,9H2,1H3/b14-7-