tridec-2-ynyl 4-ethylbenzoate

Systemtic Name: tridec-2-ynyl 4-ethylbenzoate Openeye Name: tridec-2-ynyl 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid tridec-2-ynyl ester IUPAC Name: tridec-2-ynyl 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid tridec-2-ynyl ester Formula: C22H32O2 MolecularWeight: 328.48828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CCOC(=O)C1=CC=C(C=C1)CC

Isomeric SMILES

CCCCCCCCCCC#CCOC(=O)C1=CC=C(C=C1)CC

InChI

InChI=1S/C22H32O2/c1-3-5-6-7-8-9-10-11-12-13-14-19-24-22(23)21-17-15-20(4-2)16-18-21/h15-18H,3-12,19H2,1-2H3