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

Systemtic Name: [2-chloranyl-4-(4-heptylphenyl)phenyl] 2-methylbutanoate Openeye Name: [2-chloro-4-(4-heptylphenyl)phenyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [2-chloro-4-(4-heptylphenyl)phenyl] ester IUPAC Name: [2-chloro-4-(4-heptylphenyl)phenyl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [2-chloro-4-(4-heptylphenyl)phenyl] ester Formula: C24H31ClO2 MolecularWeight: 386.95474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C(C)CC)Cl

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C(C)CC)Cl

InChI

InChI=1S/C24H31ClO2/c1-4-6-7-8-9-10-19-11-13-20(14-12-19)21-15-16-23(22(25)17-21)27-24(26)18(3)5-2/h11-18H,4-10H2,1-3H3