(E)-2-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-3-(2-methoxy-5-nitro-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-3-(2-methoxy-5-nitro-phenyl)prop-2-enenitrile Openeye Name: (E)-2-[4-(6-bromo-2-oxo-chromen-3-yl)thiazol-2-yl]-3-(2-methoxy-5-nitro-phenyl)prop-2-enenitrile CAS Name: (E)-2-[4-(6-bromo-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-3-(2-methoxy-5-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-[4-(6-bromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]-3-(2-methoxy-5-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-[4-(6-bromo-2-keto-chromen-3-yl)thiazol-2-yl]-3-(2-methoxy-5-nitro-phenyl)acrylonitrile Formula: C22H12BrN3O5S MolecularWeight: 510.31678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H12BrN3O5S/c1-30-19-5-3-16(26(28)29)8-12(19)6-14(10-24)21-25-18(11-32-21)17-9-13-7-15(23)2-4-20(13)31-22(17)27/h2-9,11H,1H3/b14-6+