3-cyclohexyl-1-[2-(dimethylamino)-2-oxidanylidene-ethyl]-2-phenyl-pyrrolo[2,3-b]pyridine-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxidanylidene-ethyl]-2-phenyl-pyrrolo[2,3-b]pyridine-6-carboxylic acid Openeye Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxo-ethyl]-2-phenyl-pyrrolo[2,3-b]pyridine-6-carboxylic acid CAS Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-2-phenyl-6-pyrrolo[2,3-b]pyridinecarboxylic acid IUPAC Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-2-phenylpyrrolo[2,3-b]pyridine-6-carboxylic acid Traditional Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-keto-ethyl]-2-phenyl-pyrrolo[2,3-b]pyridine-6-carboxylic acid Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1C(=C(C2=C1N=C(C=C2)C(=O)O)C3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CN(C)C(=O)CN1C(=C(C2=C1N=C(C=C2)C(=O)O)C3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O3/c1-26(2)20(28)15-27-22(17-11-7-4-8-12-17)21(16-9-5-3-6-10-16)18-13-14-19(24(29)30)25-23(18)27/h4,7-8,11-14,16H,3,5-6,9-10,15H2,1-2H3,(H,29,30)