[4-(3-phenylpropoxycarbonyl)phenyl] 4-butoxybenzoate

Systemtic Name: [4-(3-phenylpropoxycarbonyl)phenyl] 4-butoxybenzoate Openeye Name: [4-(3-phenylpropoxycarbonyl)phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [4-[oxo(3-phenylpropoxy)methyl]phenyl] ester IUPAC Name: [4-(3-phenylpropoxycarbonyl)phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [4-(3-phenylpropoxycarbonyl)phenyl] ester Formula: C27H28O5 MolecularWeight: 432.50822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C27H28O5/c1-2-3-19-30-24-15-11-23(12-16-24)27(29)32-25-17-13-22(14-18-25)26(28)31-20-7-10-21-8-5-4-6-9-21/h4-6,8-9,11-18H,2-3,7,10,19-20H2,1H3