3-cyclohexyl-1-[2-(dimethylamino)-2-oxidanylidene-ethyl]-2-(2-oxidanylidene-1H-pyrimidin-5-yl)indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxidanylidene-ethyl]-2-(2-oxidanylidene-1H-pyrimidin-5-yl)indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxo-ethyl]-2-(2-oxo-1H-pyrimidin-5-yl)indole-6-carboxylic acid CAS Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-2-(2-oxo-1H-pyrimidin-5-yl)-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-2-(2-oxo-1H-pyrimidin-5-yl)indole-6-carboxylic acid Traditional Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-keto-ethyl]-2-(2-keto-1H-pyrimidin-5-yl)indole-6-carboxylic acid Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1C2=C(C=CC(=C2)C(=O)O)C(=C1C3=CNC(=O)N=C3)C4CCCCC4

Isomeric SMILES

CN(C)C(=O)CN1C2=C(C=CC(=C2)C(=O)O)C(=C1C3=CNC(=O)N=C3)C4CCCCC4

InChI

InChI=1S/C23H26N4O4/c1-26(2)19(28)13-27-18-10-15(22(29)30)8-9-17(18)20(14-6-4-3-5-7-14)21(27)16-11-24-23(31)25-12-16/h8-12,14H,3-7,13H2,1-2H3,(H,29,30)(H,24,25,31)