4-(7-methoxy-1,3-benzodioxol-5-yl)-7-methyl-2-oxidanylidene-pyrano[2,3-e]indole-3-carbonitrile

Systemtic Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-7-methyl-2-oxidanylidene-pyrano[2,3-e]indole-3-carbonitrile Openeye Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-7-methyl-2-oxo-pyrano[2,3-e]indole-3-carbonitrile CAS Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-7-methyl-2-oxo-3-pyrano[2,3-e]indolecarbonitrile IUPAC Name: 4-(7-methoxy-1,3-benzodioxol-5-yl)-7-methyl-2-oxopyrano[2,3-e]indole-3-carbonitrile Traditional Name: 2-keto-4-(7-methoxy-1,3-benzodioxol-5-yl)-7-methyl-pyran[2,3-e]indole-3-carbonitrile Formula: C21H14N2O5 MolecularWeight: 374.34626

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC3=C2OC(=O)C(=C3C4=CC5=C(C(=C4)OC)OCO5)C#N

Isomeric SMILES

CN1C=CC2=C1C=CC3=C2OC(=O)C(=C3C4=CC5=C(C(=C4)OC)OCO5)C#N

InChI

InChI=1S/C21H14N2O5/c1-23-6-5-12-15(23)4-3-13-18(14(9-22)21(24)28-19(12)13)11-7-16(25-2)20-17(8-11)26-10-27-20/h3-8H,10H2,1-2H3