3,3-diphenylpropyl 3-oxidanylidene-4-(2-pyridin-3-ylethoxy)butanoate

Systemtic Name: 3,3-diphenylpropyl 3-oxidanylidene-4-(2-pyridin-3-ylethoxy)butanoate Openeye Name: 3,3-diphenylpropyl 3-oxo-4-[2-(3-pyridyl)ethoxy]butanoate CAS Name: 3-oxo-4-[2-(3-pyridinyl)ethoxy]butanoic acid 3,3-diphenylpropyl ester IUPAC Name: 3,3-diphenylpropyl 3-oxo-4-(2-pyridin-3-ylethoxy)butanoate Traditional Name: 3-keto-4-[2-(3-pyridyl)ethoxy]butyric acid 3,3-diphenylpropyl ester Formula: C26H27NO4 MolecularWeight: 417.49688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCOC(=O)CC(=O)COCCC2=CN=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CCOC(=O)CC(=O)COCCC2=CN=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H27NO4/c28-24(20-30-16-13-21-8-7-15-27-19-21)18-26(29)31-17-14-25(22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-12,15,19,25H,13-14,16-18,20H2