N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-phenylazanyl-prop-1-en-2-yl]-3,5-dinitro-benzamide

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-phenylazanyl-prop-1-en-2-yl]-3,5-dinitro-benzamide Openeye Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-(phenylcarbamoyl)vinyl]-3,5-dinitro-benzamide CAS Name: N-[(E)-3-anilino-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-3,5-dinitrobenzamide IUPAC Name: N-[(E)-3-anilino-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-3,5-dinitrobenzamide Traditional Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-(phenylcarbamoyl)vinyl]-3,5-dinitro-benzamide Formula: C23H16N4O8 MolecularWeight: 476.39514

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NC3=CC=CC=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(\C(=O)NC3=CC=CC=C3)/NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H16N4O8/c28-22(15-10-17(26(30)31)12-18(11-15)27(32)33)25-19(23(29)24-16-4-2-1-3-5-16)8-14-6-7-20-21(9-14)35-13-34-20/h1-12H,13H2,(H,24,29)(H,25,28)/b19-8+