N'-[(E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoyl]-1,3-benzodioxole-5-carbohydrazide

Systemtic Name: N'-[(E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoyl]-1,3-benzodioxole-5-carbohydrazide Openeye Name: N'-[(E)-3-(2-bromo-4-methyl-phenyl)prop-2-enoyl]-1,3-benzodioxole-5-carbohydrazide CAS Name: N'-[(E)-3-(2-bromo-4-methylphenyl)-1-oxoprop-2-enyl]-1,3-benzodioxole-5-carbohydrazide IUPAC Name: N'-[(E)-3-(2-bromo-4-methylphenyl)prop-2-enoyl]-1,3-benzodioxole-5-carbohydrazide Traditional Name: N'-[(E)-3-(2-bromo-4-methyl-phenyl)acryloyl]-1,3-benzodioxole-5-carbohydrazide Formula: C18H15BrN2O4 MolecularWeight: 403.2267

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=CC(=O)NNC(=O)C2=CC3=C(C=C2)OCO3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)/C=C/C(=O)NNC(=O)C2=CC3=C(C=C2)OCO3)Br

InChI

InChI=1S/C18H15BrN2O4/c1-11-2-3-12(14(19)8-11)5-7-17(22)20-21-18(23)13-4-6-15-16(9-13)25-10-24-15/h2-9H,10H2,1H3,(H,20,22)(H,21,23)/b7-5+