5-(3,4-dimethoxyphenyl)-2-[(phenethylamino)methylidene]cyclohexane-1,3-dione

Systemtic Name: 5-(3,4-dimethoxyphenyl)-2-[(phenethylamino)methylidene]cyclohexane-1,3-dione Openeye Name: 5-(3,4-dimethoxyphenyl)-2-[(phenethylamino)methylene]cyclohexane-1,3-dione CAS Name: 5-(3,4-dimethoxyphenyl)-2-[(phenethylamino)methylidene]cyclohexane-1,3-dione IUPAC Name: 5-(3,4-dimethoxyphenyl)-2-[(phenethylamino)methylidene]cyclohexane-1,3-dione Traditional Name: 5-(3,4-dimethoxyphenyl)-2-[(phenethylamino)methylene]cyclohexane-1,3-quinone Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=O)C(=CNCCC3=CC=CC=C3)C(=O)C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=O)C(=CNCCC3=CC=CC=C3)C(=O)C2)OC

InChI

InChI=1S/C23H25NO4/c1-27-22-9-8-17(14-23(22)28-2)18-12-20(25)19(21(26)13-18)15-24-11-10-16-6-4-3-5-7-16/h3-9,14-15,18,24H,10-13H2,1-2H3