2-[(2,3-dihydro-1H-inden-2-ylamino)methylidene]-5-(3,4-dimethoxyphenyl)cyclohexane-1,3-dione

Systemtic Name: 2-[(2,3-dihydro-1H-inden-2-ylamino)methylidene]-5-(3,4-dimethoxyphenyl)cyclohexane-1,3-dione Openeye Name: 5-(3,4-dimethoxyphenyl)-2-[(indan-2-ylamino)methylene]cyclohexane-1,3-dione CAS Name: 2-[(2,3-dihydro-1H-inden-2-ylamino)methylidene]-5-(3,4-dimethoxyphenyl)cyclohexane-1,3-dione IUPAC Name: 2-[(2,3-dihydro-1H-inden-2-ylamino)methylidene]-5-(3,4-dimethoxyphenyl)cyclohexane-1,3-dione Traditional Name: 5-(3,4-dimethoxyphenyl)-2-[(indan-2-ylamino)methylene]cyclohexane-1,3-quinone Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=O)C(=CNC3CC4=CC=CC=C4C3)C(=O)C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=O)C(=CNC3CC4=CC=CC=C4C3)C(=O)C2)OC

InChI

InChI=1S/C24H25NO4/c1-28-23-8-7-17(13-24(23)29-2)18-11-21(26)20(22(27)12-18)14-25-19-9-15-5-3-4-6-16(15)10-19/h3-8,13-14,18-19,25H,9-12H2,1-2H3