N-[(E)-1-(1,3-benzodioxol-5-yl)-3-[(2-methoxy-4-nitro-phenyl)amino]-3-oxidanylidene-prop-1-en-2-yl]-2-bromanyl-benzamide

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-[(2-methoxy-4-nitro-phenyl)amino]-3-oxidanylidene-prop-1-en-2-yl]-2-bromanyl-benzamide Openeye Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-[(2-methoxy-4-nitro-phenyl)carbamoyl]vinyl]-2-bromo-benzamide CAS Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(2-methoxy-4-nitroanilino)-3-oxoprop-1-en-2-yl]-2-bromobenzamide IUPAC Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(2-methoxy-4-nitroanilino)-3-oxoprop-1-en-2-yl]-2-bromobenzamide Traditional Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-[(2-methoxy-4-nitro-phenyl)carbamoyl]vinyl]-2-bromo-benzamide Formula: C24H18BrN3O7 MolecularWeight: 540.31962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(=CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CC=C4Br

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)/C(=C\C2=CC3=C(C=C2)OCO3)/NC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C24H18BrN3O7/c1-33-21-12-15(28(31)32)7-8-18(21)26-24(30)19(27-23(29)16-4-2-3-5-17(16)25)10-14-6-9-20-22(11-14)35-13-34-20/h2-12H,13H2,1H3,(H,26,30)(H,27,29)/b19-10+