hex-5-ynyl 4-(4-dodecanoyloxyphenyl)benzoate

Systemtic Name: hex-5-ynyl 4-(4-dodecanoyloxyphenyl)benzoate Openeye Name: hex-5-ynyl 4-(4-dodecanoyloxyphenyl)benzoate CAS Name: 4-[4-(1-oxododecoxy)phenyl]benzoic acid hex-5-ynyl ester IUPAC Name: hex-5-ynyl 4-(4-dodecanoyloxyphenyl)benzoate Traditional Name: 4-(4-lauroyloxyphenyl)benzoic acid hex-5-ynyl ester Formula: C31H40O4 MolecularWeight: 476.6469

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCCCCC#C

Isomeric SMILES

CCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCCCCC#C

InChI

InChI=1S/C31H40O4/c1-3-5-7-9-10-11-12-13-14-16-30(32)35-29-23-21-27(22-24-29)26-17-19-28(20-18-26)31(33)34-25-15-8-6-4-2/h2,17-24H,3,5-16,25H2,1H3