2-[2-[(E)-2-cyano-2-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]ethenyl]-4-nitro-phenoxy]-N-phenyl-ethanamide

Systemtic Name: 2-[2-[(E)-2-cyano-2-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]ethenyl]-4-nitro-phenoxy]-N-phenyl-ethanamide Openeye Name: 2-[2-[(E)-2-cyano-2-[4-(2-oxochromen-3-yl)thiazol-2-yl]vinyl]-4-nitro-phenoxy]-N-phenyl-acetamide CAS Name: 2-[2-[(E)-2-cyano-2-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]ethenyl]-4-nitrophenoxy]-N-phenylacetamide IUPAC Name: 2-[2-[(E)-2-cyano-2-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]ethenyl]-4-nitrophenoxy]-N-phenylacetamide Traditional Name: 2-[2-[(E)-2-cyano-2-[4-(2-ketochromen-3-yl)thiazol-2-yl]vinyl]-4-nitro-phenoxy]-N-phenyl-acetamide Formula: C29H18N4O6S MolecularWeight: 550.54142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C=C(C#N)C3=NC(=CS3)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])/C=C(\C#N)/C3=NC(=CS3)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C29H18N4O6S/c30-15-20(28-32-24(17-40-28)23-14-18-6-4-5-9-26(18)39-29(23)35)12-19-13-22(33(36)37)10-11-25(19)38-16-27(34)31-21-7-2-1-3-8-21/h1-14,17H,16H2,(H,31,34)/b20-12+