pyridin-2-ylmethyl 4-[(5-methylidene-3-oxidanylidene-1,4,6,6a-tetrahydrocyclopenta[c]furan-3a-yl)methyl]benzoate

Systemtic Name: pyridin-2-ylmethyl 4-[(5-methylidene-3-oxidanylidene-1,4,6,6a-tetrahydrocyclopenta[c]furan-3a-yl)methyl]benzoate Openeye Name: 2-pyridylmethyl 4-[(5-methylene-3-oxo-1,4,6,6a-tetrahydrocyclopenta[c]furan-3a-yl)methyl]benzoate CAS Name: 4-[(5-methylene-3-oxo-1,4,6,6a-tetrahydrocyclopenta[c]furan-3a-yl)methyl]benzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 4-[(5-methylidene-3-oxo-1,4,6,6a-tetrahydrocyclopenta[c]furan-3a-yl)methyl]benzoate Traditional Name: 4-[(3-keto-5-methylene-1,4,6,6a-tetrahydrocyclopenta[c]furan-3a-yl)methyl]benzoic acid 2-pyridylmethyl ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

C=C1CC2COC(=O)C2(C1)CC3=CC=C(C=C3)C(=O)OCC4=CC=CC=N4

Isomeric SMILES

C=C1CC2COC(=O)C2(C1)CC3=CC=C(C=C3)C(=O)OCC4=CC=CC=N4

InChI

InChI=1S/C22H21NO4/c1-15-10-18-13-27-21(25)22(18,11-15)12-16-5-7-17(8-6-16)20(24)26-14-19-4-2-3-9-23-19/h2-9,18H,1,10-14H2