[2-chloranyl-4-(4-decylphenyl)phenyl] 2-methylbutanoate

Systemtic Name: [2-chloranyl-4-(4-decylphenyl)phenyl] 2-methylbutanoate Openeye Name: [2-chloro-4-(4-decylphenyl)phenyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [2-chloro-4-(4-decylphenyl)phenyl] ester IUPAC Name: [2-chloro-4-(4-decylphenyl)phenyl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [2-chloro-4-(4-decylphenyl)phenyl] ester Formula: C27H37ClO2 MolecularWeight: 429.03448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C(C)CC)Cl

Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C(C)CC)Cl

InChI

InChI=1S/C27H37ClO2/c1-4-6-7-8-9-10-11-12-13-22-14-16-23(17-15-22)24-18-19-26(25(28)20-24)30-27(29)21(3)5-2/h14-21H,4-13H2,1-3H3