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hexadecyl (E)-3-(4-hexadecoxyphenyl)prop-2-enoate

Systemtic Name:	hexadecyl (E)-3-(4-hexadecoxyphenyl)prop-2-enoate
Openeye Name:	hexadecyl (E)-3-(4-hexadecoxyphenyl)prop-2-enoate
CAS Name:	(E)-3-(4-hexadecoxyphenyl)-2-propenoic acid hexadecyl ester
IUPAC Name:	hexadecyl (E)-3-(4-hexadecoxyphenyl)prop-2-enoate
Traditional Name:	(E)-3-(4-cetyloxyphenyl)acrylic acid cetyl ester
Formula:	C₄₁H₇₂O₃
MolecularWeight:	613.00858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C=CC(=O)OCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)/C=C/C(=O)OCCCCCCCCCCCCCCCC

InChI

InChI=1S/C41H72O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37-43-40-34-31-39(32-35-40)33-36-41(42)44-38-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-36H,3-30,37-38H2,1-2H3/b36-33+

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