3-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-6-nitro-chromen-2-one

Systemtic Name: 3-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-6-nitro-chromen-2-one Openeye Name: 3-[4-(6-bromo-2-oxo-chromen-3-yl)thiazol-2-yl]-6-nitro-chromen-2-one CAS Name: 3-[4-(6-bromo-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-6-nitro-1-benzopyran-2-one IUPAC Name: 3-[4-(6-bromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]-6-nitrochromen-2-one Traditional Name: 3-[4-(6-bromo-2-keto-chromen-3-yl)thiazol-2-yl]-6-nitro-coumarin Formula: C21H9BrN2O6S MolecularWeight: 497.27496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C=C(C(=O)O2)C3=NC(=CS3)C4=CC5=C(C=CC(=C5)Br)OC4=O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C=C(C(=O)O2)C3=NC(=CS3)C4=CC5=C(C=CC(=C5)Br)OC4=O

InChI

InChI=1S/C21H9BrN2O6S/c22-12-1-3-17-10(5-12)7-14(20(25)29-17)16-9-31-19(23-16)15-8-11-6-13(24(27)28)2-4-18(11)30-21(15)26/h1-9H