5-bromanyl-N-[(E)-3-[(4-methylphenyl)amino]-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(E)-3-[(4-methylphenyl)amino]-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]furan-2-carboxamide Openeye Name: 5-bromo-N-[(E)-2-(3-nitrophenyl)-1-(p-tolylcarbamoyl)vinyl]furan-2-carboxamide CAS Name: 5-bromo-N-[(E)-3-(4-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(E)-3-(4-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(E)-2-(3-nitrophenyl)-1-(p-tolylcarbamoyl)vinyl]-2-furamide Formula: C21H16BrN3O5 MolecularWeight: 470.27284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C21H16BrN3O5/c1-13-5-7-15(8-6-13)23-20(26)17(24-21(27)18-9-10-19(22)30-18)12-14-3-2-4-16(11-14)25(28)29/h2-12H,1H3,(H,23,26)(H,24,27)/b17-12+