6-[3-[(4-decoxyphenyl)methyl]oxiran-2-yl]hexan-3-yl benzoate

Systemtic Name: 6-[3-[(4-decoxyphenyl)methyl]oxiran-2-yl]hexan-3-yl benzoate Openeye Name: [4-[3-[(4-decoxyphenyl)methyl]oxiran-2-yl]-1-ethyl-butyl] benzoate CAS Name: benzoic acid 6-[3-[(4-decoxyphenyl)methyl]-2-oxiranyl]hexan-3-yl ester IUPAC Name: 6-[3-[(4-decoxyphenyl)methyl]oxiran-2-yl]hexan-3-yl benzoate Traditional Name: benzoic acid [4-[3-(4-decoxybenzyl)oxiran-2-yl]-1-ethyl-butyl] ester Formula: C32H46O4 MolecularWeight: 494.70524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)CC2C(O2)CCCC(CC)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)CC2C(O2)CCCC(CC)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C32H46O4/c1-3-5-6-7-8-9-10-14-24-34-29-22-20-26(21-23-29)25-31-30(36-31)19-15-18-28(4-2)35-32(33)27-16-12-11-13-17-27/h11-13,16-17,20-23,28,30-31H,3-10,14-15,18-19,24-25H2,1-2H3