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methyl (7E,9E)-5,6-dimethyl-17-phenyl-heptadeca-7,9-dien-11,14-diynoate
methyl (7E,9E)-5,6-dimethyl-17-phenyl-heptadeca-7,9-dien-11,14-diynoate
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Descriptors Computed from Structure
Canonical SMILES:
CC(CCCC(=O)OC)C(C)C=CC=CC#CCC#CCCC1=CC=CC=C1
Isomeric SMILES
CC(CCCC(=O)OC)C(C)/C=C/C=C/C#CCC#CCCC1=CC=CC=C1
InChI
InChI=1S/C26H32O2/c1-23(24(2)18-16-22-26(27)28-3)17-12-9-7-5-4-6-8-10-13-19-25-20-14-11-15-21-25/h7,9,11-12,14-15,17,20-21,23-24H,6,13,16,18-19,22H2,1-3H3/b9-7+,17-12+
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