6-[4-(1,3-benzodioxol-5-ylmethylideneamino)phenyl]-4-(3-chlorophenyl)-2-oxidanylidene-3,4-dihydropyran-3-carbonitrile

Systemtic Name: 6-[4-(1,3-benzodioxol-5-ylmethylideneamino)phenyl]-4-(3-chlorophenyl)-2-oxidanylidene-3,4-dihydropyran-3-carbonitrile Openeye Name: 6-[4-(1,3-benzodioxol-5-ylmethyleneamino)phenyl]-4-(3-chlorophenyl)-2-oxo-3,4-dihydropyran-3-carbonitrile CAS Name: 6-[4-(1,3-benzodioxol-5-ylmethylideneamino)phenyl]-4-(3-chlorophenyl)-2-oxo-3,4-dihydropyran-3-carbonitrile IUPAC Name: 6-[4-(1,3-benzodioxol-5-ylmethylideneamino)phenyl]-4-(3-chlorophenyl)-2-oxo-3,4-dihydropyran-3-carbonitrile Traditional Name: 4-(3-chlorophenyl)-2-keto-6-[4-(piperonylideneamino)phenyl]-3,4-dihydropyran-3-carbonitrile Formula: C26H17ClN2O4 MolecularWeight: 456.87718

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NC3=CC=C(C=C3)C4=CC(C(C(=O)O4)C#N)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C=NC3=CC=C(C=C3)C4=CC(C(C(=O)O4)C#N)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C26H17ClN2O4/c27-19-3-1-2-18(11-19)21-12-24(33-26(30)22(21)13-28)17-5-7-20(8-6-17)29-14-16-4-9-23-25(10-16)32-15-31-23/h1-12,14,21-22H,15H2