ethyl 5-(2,5-diethanoyl-5-phenylmethoxy-6-propyl-cyclohexa-1,3-dien-1-yl)oxypentanoate

Systemtic Name: ethyl 5-(2,5-diethanoyl-5-phenylmethoxy-6-propyl-cyclohexa-1,3-dien-1-yl)oxypentanoate Openeye Name: ethyl 5-(2,5-diacetyl-5-benzyloxy-6-propyl-cyclohexa-1,3-dien-1-yl)oxypentanoate CAS Name: 5-[(2,5-diacetyl-5-phenylmethoxy-6-propyl-1-cyclohexa-1,3-dienyl)oxy]pentanoic acid ethyl ester IUPAC Name: ethyl 5-(2,5-diacetyl-5-phenylmethoxy-6-propylcyclohexa-1,3-dien-1-yl)oxypentanoate Traditional Name: 5-(2,5-diacetyl-5-benzoxy-6-propyl-cyclohexa-1,3-dien-1-yl)oxyvaleric acid ethyl ester Formula: C27H36O6 MolecularWeight: 456.57114

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=C(C=CC1(C(=O)C)OCC2=CC=CC=C2)C(=O)C)OCCCCC(=O)OCC

Isomeric SMILES

CCCC1C(=C(C=CC1(C(=O)C)OCC2=CC=CC=C2)C(=O)C)OCCCCC(=O)OCC

InChI

InChI=1S/C27H36O6/c1-5-12-24-26(32-18-11-10-15-25(30)31-6-2)23(20(3)28)16-17-27(24,21(4)29)33-19-22-13-8-7-9-14-22/h7-9,13-14,16-17,24H,5-6,10-12,15,18-19H2,1-4H3