3-cyclohexyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-2-pyridin-2-yl-indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-2-pyridin-2-yl-indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-1-(2-morpholino-2-oxo-ethyl)-2-(2-pyridyl)indole-6-carboxylic acid CAS Name: 3-cyclohexyl-1-[2-(4-morpholinyl)-2-oxoethyl]-2-(2-pyridinyl)-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-1-(2-morpholin-4-yl-2-oxoethyl)-2-pyridin-2-ylindole-6-carboxylic acid Traditional Name: 3-cyclohexyl-1-(2-keto-2-morpholino-ethyl)-2-(2-pyridyl)indole-6-carboxylic acid Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCOCC4)C5=CC=CC=N5

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCOCC4)C5=CC=CC=N5

InChI

InChI=1S/C26H29N3O4/c30-23(28-12-14-33-15-13-28)17-29-22-16-19(26(31)32)9-10-20(22)24(18-6-2-1-3-7-18)25(29)21-8-4-5-11-27-21/h4-5,8-11,16,18H,1-3,6-7,12-15,17H2,(H,31,32)