4-(2,5-dimethylphenyl)-5-oxidanylidene-5-(3-phenylmethoxyphenyl)pentanoate

Systemtic Name: 4-(2,5-dimethylphenyl)-5-oxidanylidene-5-(3-phenylmethoxyphenyl)pentanoate Openeye Name: 5-(3-benzyloxyphenyl)-4-(2,5-dimethylphenyl)-5-oxo-pentanoate CAS Name: 4-(2,5-dimethylphenyl)-5-oxo-5-(3-phenylmethoxyphenyl)pentanoate IUPAC Name: 4-(2,5-dimethylphenyl)-5-oxo-5-(3-phenylmethoxyphenyl)pentanoate Traditional Name: 5-(3-benzoxyphenyl)-4-(2,5-dimethylphenyl)-5-keto-valerate Formula: C26H25O4- MolecularWeight: 401.4743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(CCC(=O)[O-])C(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(CCC(=O)[O-])C(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C26H26O4/c1-18-11-12-19(2)24(15-18)23(13-14-25(27)28)26(29)21-9-6-10-22(16-21)30-17-20-7-4-3-5-8-20/h3-12,15-16,23H,13-14,17H2,1-2H3,(H,27,28)/p-1