4-(3-bromanyl-4,5-dimethoxy-phenyl)-7-methyl-2-oxidanylidene-pyrano[2,3-e]indole-3-carbonitrile

Systemtic Name: 4-(3-bromanyl-4,5-dimethoxy-phenyl)-7-methyl-2-oxidanylidene-pyrano[2,3-e]indole-3-carbonitrile Openeye Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-7-methyl-2-oxo-pyrano[2,3-e]indole-3-carbonitrile CAS Name: 4-(3-bromo-4,5-dimethoxyphenyl)-7-methyl-2-oxo-3-pyrano[2,3-e]indolecarbonitrile IUPAC Name: 4-(3-bromo-4,5-dimethoxyphenyl)-7-methyl-2-oxopyrano[2,3-e]indole-3-carbonitrile Traditional Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-2-keto-7-methyl-pyran[2,3-e]indole-3-carbonitrile Formula: C21H15BrN2O4 MolecularWeight: 439.2588

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC3=C2OC(=O)C(=C3C4=CC(=C(C(=C4)Br)OC)OC)C#N

Isomeric SMILES

CN1C=CC2=C1C=CC3=C2OC(=O)C(=C3C4=CC(=C(C(=C4)Br)OC)OC)C#N

InChI

InChI=1S/C21H15BrN2O4/c1-24-7-6-12-16(24)5-4-13-18(14(10-23)21(25)28-19(12)13)11-8-15(22)20(27-3)17(9-11)26-2/h4-9H,1-3H3