(5-methyl-2-propan-2-yl-phenyl) 3-[4-(4-ethanoylphenyl)phenyl]prop-2-ynoate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) 3-[4-(4-ethanoylphenyl)phenyl]prop-2-ynoate Openeye Name: (2-isopropyl-5-methyl-phenyl) 3-[4-(4-acetylphenyl)phenyl]prop-2-ynoate CAS Name: 3-[4-(4-acetylphenyl)phenyl]-2-propynoic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) 3-[4-(4-acetylphenyl)phenyl]prop-2-ynoate Traditional Name: 3-[4-(4-acetylphenyl)phenyl]propiolic acid (2-isopropyl-5-methyl-phenyl) ester Formula: C27H24O3 MolecularWeight: 396.47766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC(=O)C#CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC(=O)C#CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C27H24O3/c1-18(2)25-15-5-19(3)17-26(25)30-27(29)16-8-21-6-9-23(10-7-21)24-13-11-22(12-14-24)20(4)28/h5-7,9-15,17-18H,1-4H3