1-(1-hexoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)oxypropan-2-yl heptanoate

Systemtic Name: 1-(1-hexoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)oxypropan-2-yl heptanoate Openeye Name: [2-(1-hexoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)oxy-1-methyl-ethyl] heptanoate CAS Name: heptanoic acid 1-[(1-hexoxy-4-phenyl-1-cyclohexa-2,5-dienyl)oxy]propan-2-yl ester IUPAC Name: 1-(1-hexoxy-4-phenylcyclohexa-2,5-dien-1-yl)oxypropan-2-yl heptanoate Traditional Name: enanthic acid [2-(1-hexoxy-4-phenyl-cyclohexa-2,5-dien-1-yl)oxy-1-methyl-ethyl] ester Formula: C28H42O4 MolecularWeight: 442.63068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC(C)COC1(C=CC(C=C1)C2=CC=CC=C2)OCCCCCC

Isomeric SMILES

CCCCCCC(=O)OC(C)COC1(C=CC(C=C1)C2=CC=CC=C2)OCCCCCC

InChI

InChI=1S/C28H42O4/c1-4-6-8-13-17-27(29)32-24(3)23-31-28(30-22-14-9-7-5-2)20-18-26(19-21-28)25-15-11-10-12-16-25/h10-12,15-16,18-21,24,26H,4-9,13-14,17,22-23H2,1-3H3