(2-methylphenyl) 4-(8-oxidanylidene-7-propanoyl-decyl)benzoate

Systemtic Name: (2-methylphenyl) 4-(8-oxidanylidene-7-propanoyl-decyl)benzoate Openeye Name: o-tolyl 4-(8-oxo-7-propanoyl-decyl)benzoate CAS Name: 4-[8-oxo-7-(1-oxopropyl)decyl]benzoic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 4-(8-oxo-7-propanoyldecyl)benzoate Traditional Name: 4-(8-keto-7-propionyl-decyl)benzoic acid o-tolyl ester Formula: C27H34O4 MolecularWeight: 422.55646

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C)C(=O)CC

Isomeric SMILES

CCC(=O)C(CCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C)C(=O)CC

InChI

InChI=1S/C27H34O4/c1-4-24(28)23(25(29)5-2)14-9-7-6-8-13-21-16-18-22(19-17-21)27(30)31-26-15-11-10-12-20(26)3/h10-12,15-19,23H,4-9,13-14H2,1-3H3