1-[4-[(4-methylphenyl)methyl]phenyl]but-3-yn-2-yl ethanoate

Systemtic Name: 1-[4-[(4-methylphenyl)methyl]phenyl]but-3-yn-2-yl ethanoate Openeye Name: 1-[[4-(p-tolylmethyl)phenyl]methyl]prop-2-ynyl acetate CAS Name: acetic acid 1-[4-[(4-methylphenyl)methyl]phenyl]but-3-yn-2-yl ester IUPAC Name: 1-[4-[(4-methylphenyl)methyl]phenyl]but-3-yn-2-yl acetate Traditional Name: acetic acid 1-[4-(4-methylbenzyl)benzyl]prop-2-ynyl ester Formula: C20H20O2 MolecularWeight: 292.3716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=CC=C(C=C2)CC(C#C)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CC2=CC=C(C=C2)CC(C#C)OC(=O)C

InChI

InChI=1S/C20H20O2/c1-4-20(22-16(3)21)14-19-11-9-18(10-12-19)13-17-7-5-15(2)6-8-17/h1,5-12,20H,13-14H2,2-3H3