3-cyclohexyl-2-[2-(3,5-dimethoxyphenyl)quinolin-6-yl]-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-2-[2-(3,5-dimethoxyphenyl)quinolin-6-yl]-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-2-[2-(3,5-dimethoxyphenyl)-6-quinolyl]-1-(2-morpholino-2-oxo-ethyl)indole-6-carboxylic acid CAS Name: 3-cyclohexyl-2-[2-(3,5-dimethoxyphenyl)-6-quinolinyl]-1-[2-(4-morpholinyl)-2-oxoethyl]-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-2-[2-(3,5-dimethoxyphenyl)quinolin-6-yl]-1-(2-morpholin-4-yl-2-oxoethyl)indole-6-carboxylic acid Traditional Name: 3-cyclohexyl-2-[2-(3,5-dimethoxyphenyl)-6-quinolyl]-1-(2-keto-2-morpholino-ethyl)indole-6-carboxylic acid Formula: C38H39N3O6 MolecularWeight: 633.73276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C2=NC3=C(C=C2)C=C(C=C3)C4=C(C5=C(N4CC(=O)N6CCOCC6)C=C(C=C5)C(=O)O)C7CCCCC7)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C2=NC3=C(C=C2)C=C(C=C3)C4=C(C5=C(N4CC(=O)N6CCOCC6)C=C(C=C5)C(=O)O)C7CCCCC7)OC

InChI

InChI=1S/C38H39N3O6/c1-45-29-19-28(20-30(22-29)46-2)33-12-9-25-18-26(10-13-32(25)39-33)37-36(24-6-4-3-5-7-24)31-11-8-27(38(43)44)21-34(31)41(37)23-35(42)40-14-16-47-17-15-40/h8-13,18-22,24H,3-7,14-17,23H2,1-2H3,(H,43,44)