N-[(E)-1-anthracen-9-yl-3-oxidanylidene-3-(pyridin-2-ylamino)prop-1-en-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(E)-1-anthracen-9-yl-3-oxidanylidene-3-(pyridin-2-ylamino)prop-1-en-2-yl]-3-nitro-benzamide Openeye Name: N-[(E)-2-(9-anthryl)-1-(2-pyridylcarbamoyl)vinyl]-3-nitro-benzamide CAS Name: N-[(E)-1-(9-anthracenyl)-3-oxo-3-(2-pyridinylamino)prop-1-en-2-yl]-3-nitrobenzamide IUPAC Name: N-[(E)-1-anthracen-9-yl-3-oxo-3-(pyridin-2-ylamino)prop-1-en-2-yl]-3-nitrobenzamide Traditional Name: N-[(E)-2-(9-anthryl)-1-(2-pyridylcarbamoyl)vinyl]-3-nitro-benzamide Formula: C29H20N4O4 MolecularWeight: 488.4935

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=C(C(=O)NC4=CC=CC=N4)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2/C=C(\C(=O)NC4=CC=CC=N4)/NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H20N4O4/c34-28(21-10-7-11-22(17-21)33(36)37)31-26(29(35)32-27-14-5-6-15-30-27)18-25-23-12-3-1-8-19(23)16-20-9-2-4-13-24(20)25/h1-18H,(H,31,34)(H,30,32,35)/b26-18+