[4-(2-oxidanylbut-3-ynyl)phenyl] 4-methylbenzoate

Systemtic Name: [4-(2-oxidanylbut-3-ynyl)phenyl] 4-methylbenzoate Openeye Name: [4-(2-hydroxybut-3-ynyl)phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-(2-hydroxybut-3-ynyl)phenyl] ester IUPAC Name: [4-(2-hydroxybut-3-ynyl)phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-(2-hydroxybut-3-ynyl)phenyl] ester Formula: C18H16O3 MolecularWeight: 280.31784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16O3/c1-3-16(19)12-14-6-10-17(11-7-14)21-18(20)15-8-4-13(2)5-9-15/h1,4-11,16,19H,12H2,2H3