2-azanyl-4-(5-bromanyl-2-methoxy-phenyl)-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-bromanyl-2-methoxy-phenyl)-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-methoxy-phenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-methoxyphenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile IUPAC Name: 2-amino-4-(5-bromo-2-methoxyphenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2-methoxy-phenyl)-5-keto-7-methyl-4H-pyrano[3,2-c]pyran-3-carbonitrile Formula: C17H13BrN2O4 MolecularWeight: 389.20012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=C(C=CC(=C3)Br)OC)C(=O)O1

Isomeric SMILES

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=C(C=CC(=C3)Br)OC)C(=O)O1

InChI

InChI=1S/C17H13BrN2O4/c1-8-5-13-15(17(21)23-8)14(11(7-19)16(20)24-13)10-6-9(18)3-4-12(10)22-2/h3-6,14H,20H2,1-2H3