1-(4-phenyl-1-undecoxy-cyclohexa-2,5-dien-1-yl)oxypropan-2-yl hexanoate

Systemtic Name: 1-(4-phenyl-1-undecoxy-cyclohexa-2,5-dien-1-yl)oxypropan-2-yl hexanoate Openeye Name: [1-methyl-2-(4-phenyl-1-undecoxy-cyclohexa-2,5-dien-1-yl)oxy-ethyl] hexanoate CAS Name: hexanoic acid 1-[(4-phenyl-1-undecoxy-1-cyclohexa-2,5-dienyl)oxy]propan-2-yl ester IUPAC Name: 1-(4-phenyl-1-undecoxycyclohexa-2,5-dien-1-yl)oxypropan-2-yl hexanoate Traditional Name: hexanoic acid [1-methyl-2-(4-phenyl-1-undecoxy-cyclohexa-2,5-dien-1-yl)oxy-ethyl] ester Formula: C32H50O4 MolecularWeight: 498.737

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)OCC(C)OC(=O)CCCCC

Isomeric SMILES

CCCCCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)OCC(C)OC(=O)CCCCC

InChI

InChI=1S/C32H50O4/c1-4-6-8-9-10-11-12-13-18-26-34-32(35-27-28(3)36-31(33)21-15-7-5-2)24-22-30(23-25-32)29-19-16-14-17-20-29/h14,16-17,19-20,22-25,28,30H,4-13,15,18,21,26-27H2,1-3H3