N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(pyridin-2-ylamino)prop-1-en-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(pyridin-2-ylamino)prop-1-en-2-yl]-3-nitro-benzamide Openeye Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-(2-pyridylcarbamoyl)vinyl]-3-nitro-benzamide CAS Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(2-pyridinylamino)prop-1-en-2-yl]-3-nitrobenzamide IUPAC Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(pyridin-2-ylamino)prop-1-en-2-yl]-3-nitrobenzamide Traditional Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-(2-pyridylcarbamoyl)vinyl]-3-nitro-benzamide Formula: C22H16N4O6 MolecularWeight: 432.38564

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NC3=CC=CC=N3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(\C(=O)NC3=CC=CC=N3)/NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O6/c27-21(15-4-3-5-16(12-15)26(29)30)24-17(22(28)25-20-6-1-2-9-23-20)10-14-7-8-18-19(11-14)32-13-31-18/h1-12H,13H2,(H,24,27)(H,23,25,28)/b17-10+