(2E)-2-[2-ethoxy-2-(4-fluorophenyl)-3-oxidanylidene-isoindol-2-ium-1-ylidene]ethanal

Systemtic Name: (2E)-2-[2-ethoxy-2-(4-fluorophenyl)-3-oxidanylidene-isoindol-2-ium-1-ylidene]ethanal Openeye Name: (2E)-2-[2-ethoxy-2-(4-fluorophenyl)-3-oxo-isoindolin-2-ium-1-ylidene]acetaldehyde CAS Name: (2E)-2-[2-ethoxy-2-(4-fluorophenyl)-3-oxo-1-isoindol-2-iumylidene]acetaldehyde IUPAC Name: (2E)-2-[2-ethoxy-2-(4-fluorophenyl)-3-oxoisoindol-2-ium-1-ylidene]acetaldehyde Traditional Name: (2E)-2-[2-ethoxy-2-(4-fluorophenyl)-3-keto-isoindolin-2-ium-1-ylidene]acetaldehyde Formula: C18H15FNO3+ MolecularWeight: 312.315003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCO[N+]1(C(=CC=O)C2=CC=CC=C2C1=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCO[N+]1(/C(=C/C=O)/C2=CC=CC=C2C1=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H15FNO3/c1-2-23-20(14-9-7-13(19)8-10-14)17(11-12-21)15-5-3-4-6-16(15)18(20)22/h3-12H,2H2,1H3/q+1/b17-11+