2-azanyl-4-(6-bromanyl-4-oxidanylidene-chromen-3-yl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-(6-bromanyl-4-oxidanylidene-chromen-3-yl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-(6-bromo-4-oxo-chromen-3-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-(6-bromo-4-oxo-1-benzopyran-3-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(6-bromo-4-oxochromen-3-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-(6-bromo-4-keto-chromen-3-yl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C21H17BrN2O4 MolecularWeight: 441.27468

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=COC4=C(C3=O)C=C(C=C4)Br)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=COC4=C(C3=O)C=C(C=C4)Br)C(=O)C1)C

InChI

InChI=1S/C21H17BrN2O4/c1-21(2)6-14(25)18-16(7-21)28-20(24)12(8-23)17(18)13-9-27-15-4-3-10(22)5-11(15)19(13)26/h3-5,9,17H,6-7,24H2,1-2H3