(E)-3-(4-methoxyphenyl)-2-[4-(6-nitro-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile

Systemtic Name: (E)-3-(4-methoxyphenyl)-2-[4-(6-nitro-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile Openeye Name: (E)-3-(4-methoxyphenyl)-2-[4-(6-nitro-2-oxo-chromen-3-yl)thiazol-2-yl]prop-2-enenitrile CAS Name: (E)-3-(4-methoxyphenyl)-2-[4-(6-nitro-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-2-propenenitrile IUPAC Name: (E)-3-(4-methoxyphenyl)-2-[4-(6-nitro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile Traditional Name: (E)-2-[4-(2-keto-6-nitro-chromen-3-yl)thiazol-2-yl]-3-(4-methoxyphenyl)acrylonitrile Formula: C22H13N3O5S MolecularWeight: 431.42072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C#N)/C2=NC(=CS2)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C22H13N3O5S/c1-29-17-5-2-13(3-6-17)8-15(11-23)21-24-19(12-31-21)18-10-14-9-16(25(27)28)4-7-20(14)30-22(18)26/h2-10,12H,1H3/b15-8+