3-cyclohexyl-2-[2-(2-fluorophenyl)quinolin-6-yl]-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-2-[2-(2-fluorophenyl)quinolin-6-yl]-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-2-[2-(2-fluorophenyl)-6-quinolyl]-1-(2-morpholino-2-oxo-ethyl)indole-6-carboxylic acid CAS Name: 3-cyclohexyl-2-[2-(2-fluorophenyl)-6-quinolinyl]-1-[2-(4-morpholinyl)-2-oxoethyl]-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-2-[2-(2-fluorophenyl)quinolin-6-yl]-1-(2-morpholin-4-yl-2-oxoethyl)indole-6-carboxylic acid Traditional Name: 3-cyclohexyl-2-[2-(2-fluorophenyl)-6-quinolyl]-1-(2-keto-2-morpholino-ethyl)indole-6-carboxylic acid Formula: C36H34FN3O4 MolecularWeight: 591.671263

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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=CC6=C(C=C5)N=C(C=C6)C7=CC=CC=C7F

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCOCC4)C5=CC6=C(C=C5)N=C(C=C6)C7=CC=CC=C7F

InChI

InChI=1S/C36H34FN3O4/c37-29-9-5-4-8-27(29)31-15-11-24-20-25(12-14-30(24)38-31)35-34(23-6-2-1-3-7-23)28-13-10-26(36(42)43)21-32(28)40(35)22-33(41)39-16-18-44-19-17-39/h4-5,8-15,20-21,23H,1-3,6-7,16-19,22H2,(H,42,43)