(5-oxidanylidene-3,3a,8,8a-tetrahydro-2H-furo[3,2-b]oxepin-2-yl)methyl 2-phenylethanoate

Systemtic Name: (5-oxidanylidene-3,3a,8,8a-tetrahydro-2H-furo[3,2-b]oxepin-2-yl)methyl 2-phenylethanoate Openeye Name: (5-oxo-3,3a,8,8a-tetrahydro-2H-furo[3,2-b]oxepin-2-yl)methyl 2-phenylacetate CAS Name: 2-phenylacetic acid (5-oxo-3,3a,8,8a-tetrahydro-2H-furo[3,2-b]oxepin-2-yl)methyl ester IUPAC Name: (5-oxo-3,3a,8,8a-tetrahydro-2H-furo[3,2-b]oxepin-2-yl)methyl 2-phenylacetate Traditional Name: 2-phenylacetic acid (5-keto-3,3a,8,8a-tetrahydro-2H-furo[3,2-b]oxepin-2-yl)methyl ester Formula: C17H18O5 MolecularWeight: 302.32182

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=O)OC2C1OC(C2)COC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1C=CC(=O)OC2C1OC(C2)COC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C17H18O5/c18-16-8-4-7-14-15(22-16)10-13(21-14)11-20-17(19)9-12-5-2-1-3-6-12/h1-6,8,13-15H,7,9-11H2