N-[(E)-1-(1,3-benzodioxol-5-yl)-3-[(2E)-2-[(3-bromanyl-4,5-dimethoxy-phenyl)methylidene]hydrazinyl]-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-[(2E)-2-[(3-bromanyl-4,5-dimethoxy-phenyl)methylidene]hydrazinyl]-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-[[(E)-(3-bromo-4,5-dimethoxy-phenyl)methyleneamino]carbamoyl]vinyl]benzamide CAS Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-[(2E)-2-[(3-bromo-4,5-dimethoxyphenyl)methylidene]hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-[(2E)-2-[(3-bromo-4,5-dimethoxyphenyl)methylidene]hydrazinyl]-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-[[(E)-(3-bromo-4,5-dimethoxy-benzylidene)amino]carbamoyl]vinyl]benzamide Formula: C26H22BrN3O6 MolecularWeight: 552.37338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)C(=CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CC=C4)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=O)/C(=C\C2=CC3=C(C=C2)OCO3)/NC(=O)C4=CC=CC=C4)Br)OC

InChI

InChI=1S/C26H22BrN3O6/c1-33-23-13-17(10-19(27)24(23)34-2)14-28-30-26(32)20(29-25(31)18-6-4-3-5-7-18)11-16-8-9-21-22(12-16)36-15-35-21/h3-14H,15H2,1-2H3,(H,29,31)(H,30,32)/b20-11+,28-14+