(7-oxidanylidene-3-propan-2-yl-cyclohepta-1,3,5-trien-1-yl) 4-methoxybenzoate

Systemtic Name: (7-oxidanylidene-3-propan-2-yl-cyclohepta-1,3,5-trien-1-yl) 4-methoxybenzoate Openeye Name: (3-isopropyl-7-oxo-cyclohepta-1,3,5-trien-1-yl) 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid (7-oxo-3-propan-2-yl-1-cyclohepta-1,3,5-trienyl) ester IUPAC Name: (7-oxo-3-propan-2-ylcyclohepta-1,3,5-trien-1-yl) 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid (3-isopropyl-7-keto-cyclohepta-1,3,5-trien-1-yl) ester Formula: C18H18O4 MolecularWeight: 298.33312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC(=O)C(=C1)OC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)C1=CC=CC(=O)C(=C1)OC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H18O4/c1-12(2)14-5-4-6-16(19)17(11-14)22-18(20)13-7-9-15(21-3)10-8-13/h4-12H,1-3H3