2-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4,5-bis(4-methoxyphenyl)furan-3-carbonitrile

Systemtic Name: 2-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4,5-bis(4-methoxyphenyl)furan-3-carbonitrile Openeye Name: 2-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-4,5-bis(4-methoxyphenyl)furan-3-carbonitrile CAS Name: 2-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4,5-bis(4-methoxyphenyl)-3-furancarbonitrile IUPAC Name: 2-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4,5-bis(4-methoxyphenyl)furan-3-carbonitrile Traditional Name: 4,5-bis(4-methoxyphenyl)-2-[(E)-piperonylideneamino]-3-furonitrile Formula: C27H20N2O5 MolecularWeight: 452.4581

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(OC(=C2C#N)N=CC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(OC(=C2C#N)/N=C/C3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H20N2O5/c1-30-20-8-4-18(5-9-20)25-22(14-28)27(34-26(25)19-6-10-21(31-2)11-7-19)29-15-17-3-12-23-24(13-17)33-16-32-23/h3-13,15H,16H2,1-2H3/b29-15+