[4-[4-(2-methylpropanoyloxy)phenoxy]carbonylphenyl] 4-prop-1-ynylbenzoate

Systemtic Name: [4-[4-(2-methylpropanoyloxy)phenoxy]carbonylphenyl] 4-prop-1-ynylbenzoate Openeye Name: [4-[4-(2-methylpropanoyloxy)phenoxy]carbonylphenyl] 4-prop-1-ynylbenzoate CAS Name: 4-prop-1-ynylbenzoic acid [4-[[4-(2-methyl-1-oxopropoxy)phenoxy]-oxomethyl]phenyl] ester IUPAC Name: [4-[4-(2-methylpropanoyloxy)phenoxy]carbonylphenyl] 4-prop-1-ynylbenzoate Traditional Name: 4-prop-1-ynylbenzoic acid [4-(4-isobutyryloxyphenoxy)carbonylphenyl] ester Formula: C27H22O6 MolecularWeight: 442.45998

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OC(=O)C(C)C

Isomeric SMILES

CC#CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OC(=O)C(C)C

InChI

InChI=1S/C27H22O6/c1-4-5-19-6-8-20(9-7-19)26(29)32-22-12-10-21(11-13-22)27(30)33-24-16-14-23(15-17-24)31-25(28)18(2)3/h6-18H,1-3H3