2-(6-cyano-9-oxidanylidene-xanthen-2-yl)oxyethyl butanoate

Systemtic Name: 2-(6-cyano-9-oxidanylidene-xanthen-2-yl)oxyethyl butanoate Openeye Name: 2-(6-cyano-9-oxo-xanthen-2-yl)oxyethyl butanoate CAS Name: butanoic acid 2-[(6-cyano-9-oxo-2-xanthenyl)oxy]ethyl ester IUPAC Name: 2-(6-cyano-9-oxoxanthen-2-yl)oxyethyl butanoate Traditional Name: butyric acid 2-(6-cyano-9-keto-xanthen-2-yl)oxyethyl ester Formula: C20H17NO5 MolecularWeight: 351.35268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCCOC1=CC2=C(C=C1)OC3=C(C2=O)C=CC(=C3)C#N

Isomeric SMILES

CCCC(=O)OCCOC1=CC2=C(C=C1)OC3=C(C2=O)C=CC(=C3)C#N

InChI

InChI=1S/C20H17NO5/c1-2-3-19(22)25-9-8-24-14-5-7-17-16(11-14)20(23)15-6-4-13(12-21)10-18(15)26-17/h4-7,10-11H,2-3,8-9H2,1H3