3-cyclohexyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-2-[2-(7-oxidanyl-1-benzofuran-2-yl)quinolin-6-yl]indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-2-[2-(7-oxidanyl-1-benzofuran-2-yl)quinolin-6-yl]indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-2-[2-(7-hydroxybenzofuran-2-yl)-6-quinolyl]-1-(2-morpholino-2-oxo-ethyl)indole-6-carboxylic acid CAS Name: 3-cyclohexyl-2-[2-(7-hydroxy-2-benzofuranyl)-6-quinolinyl]-1-[2-(4-morpholinyl)-2-oxoethyl]-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-2-[2-(7-hydroxy-1-benzofuran-2-yl)quinolin-6-yl]-1-(2-morpholin-4-yl-2-oxoethyl)indole-6-carboxylic acid Traditional Name: 3-cyclohexyl-2-[2-(7-hydroxybenzofuran-2-yl)-6-quinolyl]-1-(2-keto-2-morpholino-ethyl)indole-6-carboxylic acid Formula: C38H35N3O6 MolecularWeight: 629.701

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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=CC8=C(O7)C(=CC=C8)O

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=CC8=C(O7)C(=CC=C8)O

InChI

InChI=1S/C38H35N3O6/c42-32-8-4-7-26-21-33(47-37(26)32)30-14-10-24-19-25(11-13-29(24)39-30)36-35(23-5-2-1-3-6-23)28-12-9-27(38(44)45)20-31(28)41(36)22-34(43)40-15-17-46-18-16-40/h4,7-14,19-21,23,42H,1-3,5-6,15-18,22H2,(H,44,45)