4,5-bis(4-methoxyphenyl)-2-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]furan-3-carbonitrile

Systemtic Name: 4,5-bis(4-methoxyphenyl)-2-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]furan-3-carbonitrile Openeye Name: 4,5-bis(4-methoxyphenyl)-2-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]furan-3-carbonitrile CAS Name: 4,5-bis(4-methoxyphenyl)-2-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-3-furancarbonitrile IUPAC Name: 4,5-bis(4-methoxyphenyl)-2-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]furan-3-carbonitrile Traditional Name: 4,5-bis(4-methoxyphenyl)-2-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-3-furonitrile Formula: C27H19N3O7 MolecularWeight: 497.45566

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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[N+](=O)[O-])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[N+](=O)[O-])OCO4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H19N3O7/c1-33-19-7-3-16(4-8-19)25-21(13-28)27(37-26(25)17-5-9-20(34-2)10-6-17)29-14-18-11-23-24(36-15-35-23)12-22(18)30(31)32/h3-12,14H,15H2,1-2H3/b29-14+