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1-(1-heptyl-4-phenyl-cyclohexa-2,5-dien-1-yl)oxypropan-2-yl 5-methylheptanoate

1-(1-heptyl-4-phenyl-cyclohexa-2,5-dien-1-yl)oxypropan-2-yl 5-methylheptanoate

Systemtic Name:1-(1-heptyl-4-phenyl-cyclohexa-2,5-dien-1-yl)oxypropan-2-yl 5-methylheptanoate
Openeye Name:[2-(1-heptyl-4-phenyl-cyclohexa-2,5-dien-1-yl)oxy-1-methyl-ethyl] 5-methylheptanoate
CAS Name:5-methylheptanoic acid 1-[(1-heptyl-4-phenyl-1-cyclohexa-2,5-dienyl)oxy]propan-2-yl ester
IUPAC Name:1-(1-heptyl-4-phenylcyclohexa-2,5-dien-1-yl)oxypropan-2-yl 5-methylheptanoate
Traditional Name:5-methylenanthic acid [2-(1-heptyl-4-phenyl-cyclohexa-2,5-dien-1-yl)oxy-1-methyl-ethyl] ester
Formula: C30H46O3
MolecularWeight: 454.68444
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(C=CC(C=C1)C2=CC=CC=C2)OCC(C)OC(=O)CCCC(C)CC


Isomeric SMILES

CCCCCCCC1(C=CC(C=C1)C2=CC=CC=C2)OCC(C)OC(=O)CCCC(C)CC


InChI

InChI=1S/C30H46O3/c1-5-7-8-9-13-21-30(22-19-28(20-23-30)27-16-11-10-12-17-27)32-24-26(4)33-29(31)18-14-15-25(3)6-2/h10-12,16-17,19-20,22-23,25-26,28H,5-9,13-15,18,21,24H2,1-4H3


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