[(2E,6Z)-1,1-diacetyloxy-3-methanoyl-7,11-dimethyl-dodeca-2,6,10-trien-8-yn-4-yl] ethanoate

Systemtic Name: [(2E,6Z)-1,1-diacetyloxy-3-methanoyl-7,11-dimethyl-dodeca-2,6,10-trien-8-yn-4-yl] ethanoate Openeye Name: [(3Z)-1-[(E)-3,3-diacetoxy-1-formyl-prop-1-enyl]-4,8-dimethyl-nona-3,7-dien-5-ynyl] acetate CAS Name: acetic acid [(2E,6Z)-1,1-diacetyloxy-3-formyl-7,11-dimethyldodeca-2,6,10-trien-8-yn-4-yl] ester IUPAC Name: [(2E,6Z)-1,1-diacetyloxy-3-formyl-7,11-dimethyldodeca-2,6,10-trien-8-yn-4-yl] acetate Traditional Name: acetic acid [(3Z)-1-[(E)-3,3-diacetoxy-1-formyl-prop-1-enyl]-4,8-dimethyl-nona-3,7-dien-5-ynyl] ester Formula: C21H26O7 MolecularWeight: 390.42694

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC#CC(=CCC(C(=CC(OC(=O)C)OC(=O)C)C=O)OC(=O)C)C)C

Isomeric SMILES

CC(=CC#C/C(=C\CC(/C(=C\C(OC(=O)C)OC(=O)C)/C=O)OC(=O)C)/C)C

InChI

InChI=1S/C21H26O7/c1-14(2)8-7-9-15(3)10-11-20(26-16(4)23)19(13-22)12-21(27-17(5)24)28-18(6)25/h8,10,12-13,20-21H,11H2,1-6H3/b15-10-,19-12-