ethanol; ethyl 2-(3-oxidanyl-2-oxidanylidene-3-phenacyl-indol-1-yl)ethanoate

Systemtic Name: ethanol; ethyl 2-(3-oxidanyl-2-oxidanylidene-3-phenacyl-indol-1-yl)ethanoate Openeye Name: ethanol; ethyl 2-(3-hydroxy-2-oxo-3-phenacyl-indolin-1-yl)acetate CAS Name: ethanol; 2-(3-hydroxy-2-oxo-3-phenacyl-1-indolyl)acetic acid ethyl ester IUPAC Name: ethanol; ethyl 2-(3-hydroxy-2-oxo-3-phenacylindol-1-yl)acetate Traditional Name: ethanol; 2-(3-hydroxy-2-keto-3-phenacyl-indolin-1-yl)acetic acid ethyl ester Formula: C22H25NO6 MolecularWeight: 399.437

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCO.CCOC(=O)CN1C2=CC=CC=C2C(C1=O)(CC(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCO.CCOC(=O)CN1C2=CC=CC=C2C(C1=O)(CC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C20H19NO5.C2H6O/c1-2-26-18(23)13-21-16-11-7-6-10-15(16)20(25,19(21)24)12-17(22)14-8-4-3-5-9-14;1-2-3/h3-11,25H,2,12-13H2,1H3;3H,2H2,1H3