(2,4,6-trimethyl-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl) 4-chloranylbenzoate

Systemtic Name: (2,4,6-trimethyl-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl) 4-chloranylbenzoate Openeye Name: (2,4,6-trimethyl-7-oxo-cyclohepta-1,3,5-trien-1-yl) 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid (2,4,6-trimethyl-7-oxo-1-cyclohepta-1,3,5-trienyl) ester IUPAC Name: (2,4,6-trimethyl-7-oxocyclohepta-1,3,5-trien-1-yl) 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid (7-keto-2,4,6-trimethyl-cyclohepta-1,3,5-trien-1-yl) ester Formula: C17H15ClO3 MolecularWeight: 302.7522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)C(=C1)C)OC(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=O)C(=C1)C)OC(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C17H15ClO3/c1-10-8-11(2)15(19)16(12(3)9-10)21-17(20)13-4-6-14(18)7-5-13/h4-9H,1-3H3