O1,O1-diethyl O7-methyl (4E,6E)-2-cyclopentyl-3-oxidanylidene-hepta-4,6-diene-1,1,7-tricarboxylate

Systemtic Name: O1,O1-diethyl O7-methyl (4E,6E)-2-cyclopentyl-3-oxidanylidene-hepta-4,6-diene-1,1,7-tricarboxylate Openeye Name: O1,O1-diethyl O7-methyl (4E,6E)-2-cyclopentyl-3-oxo-hepta-4,6-diene-1,1,7-tricarboxylate CAS Name: (4E,6E)-2-cyclopentyl-3-oxohepta-4,6-diene-1,1,7-tricarboxylic acid O1,O1-diethyl ester O7-methyl ester IUPAC Name: 1-O,1-O-diethyl 7-O-methyl (4E,6E)-2-cyclopentyl-3-oxohepta-4,6-diene-1,1,7-tricarboxylate Traditional Name: (4E,6E)-2-cyclopentyl-3-keto-hepta-4,6-diene-1,1,7-tricarboxylic acid O1,O1-diethyl ester O7-methyl ester Formula: C20H28O7 MolecularWeight: 380.43212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1CCCC1)C(=O)C=CC=CC(=O)OC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(C1CCCC1)C(=O)/C=C/C=C/C(=O)OC)C(=O)OCC

InChI

InChI=1S/C20H28O7/c1-4-26-19(23)18(20(24)27-5-2)17(14-10-6-7-11-14)15(21)12-8-9-13-16(22)25-3/h8-9,12-14,17-18H,4-7,10-11H2,1-3H3/b12-8+,13-9+