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

Systemtic Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-iodanyl-4-methyl-phenyl)-1,3-oxazol-5-one Openeye Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylene)-2-(3-iodo-4-methyl-phenyl)oxazol-5-one CAS Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-iodo-4-methylphenyl)-5-oxazolone IUPAC Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-iodo-4-methylphenyl)-1,3-oxazol-5-one Traditional Name: (4Z)-2-(3-iodo-4-methyl-phenyl)-4-piperonylidene-2-oxazolin-5-one Formula: C18H12INO4 MolecularWeight: 433.19665

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12INO4/c1-10-2-4-12(8-13(10)19)17-20-14(18(21)24-17)6-11-3-5-15-16(7-11)23-9-22-15/h2-8H,9H2,1H3/b14-6-