(3-phenoxyphenyl)methyl 2-(4-prop-2-ynylphenyl)butanoate

Systemtic Name: (3-phenoxyphenyl)methyl 2-(4-prop-2-ynylphenyl)butanoate Openeye Name: (3-phenoxyphenyl)methyl 2-(4-prop-2-ynylphenyl)butanoate CAS Name: 2-(4-prop-2-ynylphenyl)butanoic acid (3-phenoxyphenyl)methyl ester IUPAC Name: (3-phenoxyphenyl)methyl 2-(4-prop-2-ynylphenyl)butanoate Traditional Name: 2-(4-propargylphenyl)butyric acid (3-phenoxybenzyl) ester Formula: C26H24O3 MolecularWeight: 384.46696

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)CC#C)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCC(C1=CC=C(C=C1)CC#C)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C26H24O3/c1-3-9-20-14-16-22(17-15-20)25(4-2)26(27)28-19-21-10-8-13-24(18-21)29-23-11-6-5-7-12-23/h1,5-8,10-18,25H,4,9,19H2,2H3