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

Systemtic Name: 2-azanyl-4-(3-bromanyl-4-methoxy-phenyl)-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4-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=CC(=C(C=C3)OC)Br)C(=O)O1

Isomeric SMILES

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

InChI

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