N-(2-ethylhexyl)-2-[1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]ethanamide

Systemtic Name: N-(2-ethylhexyl)-2-[1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]ethanamide Openeye Name: N-(2-ethylhexyl)-2-[1-(1H-indol-3-yl)-3-oxo-isoindolin-2-yl]acetamide CAS Name: N-(2-ethylhexyl)-2-[1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]acetamide IUPAC Name: N-(2-ethylhexyl)-2-[1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]acetamide Traditional Name: N-(2-ethylhexyl)-2-[1-(1H-indol-3-yl)-3-keto-isoindolin-2-yl]acetamide Formula: C26H31N3O2 MolecularWeight: 417.54324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)CN1C(C2=CC=CC=C2C1=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CCCCC(CC)CNC(=O)CN1C(C2=CC=CC=C2C1=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C26H31N3O2/c1-3-5-10-18(4-2)15-28-24(30)17-29-25(20-12-6-7-13-21(20)26(29)31)22-16-27-23-14-9-8-11-19(22)23/h6-9,11-14,16,18,25,27H,3-5,10,15,17H2,1-2H3,(H,28,30)