[5-acetyloxy-2-[(4-methoxyphenyl)methoxy]-4,7,7-trimethyl-cyclohept-3-en-1-yl] benzoate

Systemtic Name: [5-acetyloxy-2-[(4-methoxyphenyl)methoxy]-4,7,7-trimethyl-cyclohept-3-en-1-yl] benzoate Openeye Name: [5-acetoxy-2-[(4-methoxyphenyl)methoxy]-4,7,7-trimethyl-cyclohept-3-en-1-yl] benzoate CAS Name: benzoic acid [5-acetyloxy-2-[(4-methoxyphenyl)methoxy]-4,7,7-trimethyl-1-cyclohept-3-enyl] ester IUPAC Name: [5-acetyloxy-2-[(4-methoxyphenyl)methoxy]-4,7,7-trimethylcyclohept-3-en-1-yl] benzoate Traditional Name: benzoic acid (5-acetoxy-4,7,7-trimethyl-2-p-anisyloxy-cyclohept-3-en-1-yl) ester Formula: C27H32O6 MolecularWeight: 452.53938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(C(CC1OC(=O)C)(C)C)OC(=O)C2=CC=CC=C2)OCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(C(C(CC1OC(=O)C)(C)C)OC(=O)C2=CC=CC=C2)OCC3=CC=C(C=C3)OC

InChI

InChI=1S/C27H32O6/c1-18-15-23(31-17-20-11-13-22(30-5)14-12-20)25(27(3,4)16-24(18)32-19(2)28)33-26(29)21-9-7-6-8-10-21/h6-15,23-25H,16-17H2,1-5H3