(4-but-3-ynylphenyl) 4-methylbenzoate

Systemtic Name: (4-but-3-ynylphenyl) 4-methylbenzoate Openeye Name: (4-but-3-ynylphenyl) 4-methylbenzoate CAS Name: 4-methylbenzoic acid (4-but-3-ynylphenyl) ester IUPAC Name: (4-but-3-ynylphenyl) 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (4-but-3-ynylphenyl) ester Formula: C18H16O2 MolecularWeight: 264.31844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CCC#C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CCC#C

InChI

InChI=1S/C18H16O2/c1-3-4-5-15-8-12-17(13-9-15)20-18(19)16-10-6-14(2)7-11-16/h1,6-13H,4-5H2,2H3