phenyl 5-(2-methylbutanoyl)-4-octoxy-3-oxidanyl-2-phenyl-benzoate

Systemtic Name: phenyl 5-(2-methylbutanoyl)-4-octoxy-3-oxidanyl-2-phenyl-benzoate Openeye Name: phenyl 3-hydroxy-5-(2-methylbutanoyl)-4-octoxy-2-phenyl-benzoate CAS Name: 3-hydroxy-5-(2-methyl-1-oxobutyl)-4-octoxy-2-phenylbenzoic acid phenyl ester IUPAC Name: phenyl 3-hydroxy-5-(2-methylbutanoyl)-4-octoxy-2-phenylbenzoate Traditional Name: 3-hydroxy-5-(2-methylbutanoyl)-4-octoxy-2-phenyl-benzoic acid phenyl ester Formula: C32H38O5 MolecularWeight: 502.64112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C(=C1O)C2=CC=CC=C2)C(=O)OC3=CC=CC=C3)C(=O)C(C)CC

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C(=C1O)C2=CC=CC=C2)C(=O)OC3=CC=CC=C3)C(=O)C(C)CC

InChI

InChI=1S/C32H38O5/c1-4-6-7-8-9-16-21-36-31-27(29(33)23(3)5-2)22-26(32(35)37-25-19-14-11-15-20-25)28(30(31)34)24-17-12-10-13-18-24/h10-15,17-20,22-23,34H,4-9,16,21H2,1-3H3