3-[(3,4-dimethoxyphenyl)methyl]-1-(2,2-dimethyl-1,3-dioxan-5-yl)-2-oxidanylidene-benzimidazole-5-carbonitrile

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methyl]-1-(2,2-dimethyl-1,3-dioxan-5-yl)-2-oxidanylidene-benzimidazole-5-carbonitrile Openeye Name: 3-[(3,4-dimethoxyphenyl)methyl]-1-(2,2-dimethyl-1,3-dioxan-5-yl)-2-oxo-benzimidazole-5-carbonitrile CAS Name: 3-[(3,4-dimethoxyphenyl)methyl]-1-(2,2-dimethyl-1,3-dioxan-5-yl)-2-oxo-5-benzimidazolecarbonitrile IUPAC Name: 3-[(3,4-dimethoxyphenyl)methyl]-1-(2,2-dimethyl-1,3-dioxan-5-yl)-2-oxobenzimidazole-5-carbonitrile Traditional Name: 1-(2,2-dimethyl-1,3-dioxan-5-yl)-2-keto-3-veratryl-benzimidazole-5-carbonitrile Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)N2C3=C(C=C(C=C3)C#N)N(C2=O)CC4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CC1(OCC(CO1)N2C3=C(C=C(C=C3)C#N)N(C2=O)CC4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C23H25N3O5/c1-23(2)30-13-17(14-31-23)26-18-7-5-15(11-24)9-19(18)25(22(26)27)12-16-6-8-20(28-3)21(10-16)29-4/h5-10,17H,12-14H2,1-4H3