2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-2-indol-1-yl-3,3-dimethyl-5-oxidanylidene-hexanoic acid

Systemtic Name: 2-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-2-indol-1-yl-3,3-dimethyl-5-oxidanylidene-hexanoic acid Openeye Name: 2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-2-indol-1-yl-3,3-dimethyl-5-oxo-hexanoic acid CAS Name: 2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-2-(1-indolyl)-3,3-dimethyl-5-oxohexanoic acid IUPAC Name: 2-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-2-indol-1-yl-3,3-dimethyl-5-oxohexanoic acid Traditional Name: 2-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-2-indol-1-yl-5-keto-3,3-dimethyl-hexanoic acid Formula: C28H32FN3O5 MolecularWeight: 509.569183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C2C(=C1)CN(C2=N)C(C(=O)O)(C(C)(C)CC(=O)C)N3C=CC4=CC=CC=C43)F)OCC

Isomeric SMILES

CCOC1=C(C(=C2C(=C1)CN(C2=N)C(C(=O)O)(C(C)(C)CC(=O)C)N3C=CC4=CC=CC=C43)F)OCC

InChI

InChI=1S/C28H32FN3O5/c1-6-36-21-14-19-16-32(25(30)22(19)23(29)24(21)37-7-2)28(26(34)35,27(4,5)15-17(3)33)31-13-12-18-10-8-9-11-20(18)31/h8-14,30H,6-7,15-16H2,1-5H3,(H,34,35)