(5-methanoyl-2,4,4-trimethyl-cyclohexa-2,5-dien-1-yl) (E)-2-(acetyloxymethyl)but-2-enoate

Systemtic Name: (5-methanoyl-2,4,4-trimethyl-cyclohexa-2,5-dien-1-yl) (E)-2-(acetyloxymethyl)but-2-enoate Openeye Name: (5-formyl-2,4,4-trimethyl-cyclohexa-2,5-dien-1-yl) (E)-2-(acetoxymethyl)but-2-enoate CAS Name: (E)-2-(acetyloxymethyl)-2-butenoic acid (5-formyl-2,4,4-trimethyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (5-formyl-2,4,4-trimethylcyclohexa-2,5-dien-1-yl) (E)-2-(acetyloxymethyl)but-2-enoate Traditional Name: (E)-2-(acetoxymethyl)but-2-enoic acid (5-formyl-2,4,4-trimethyl-cyclohexa-2,5-dien-1-yl) ester Formula: C17H22O5 MolecularWeight: 306.35358

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(COC(=O)C)C(=O)OC1C=C(C(C=C1C)(C)C)C=O

Isomeric SMILES

C/C=C(\COC(=O)C)/C(=O)OC1C=C(C(C=C1C)(C)C)C=O

InChI

InChI=1S/C17H22O5/c1-6-13(10-21-12(3)19)16(20)22-15-7-14(9-18)17(4,5)8-11(15)2/h6-9,15H,10H2,1-5H3/b13-6+