3-(2-methylbutyl)-4-phenyl-benzoate

Systemtic Name: 3-(2-methylbutyl)-4-phenyl-benzoate Openeye Name: 3-(2-methylbutyl)-4-phenyl-benzoate CAS Name: 3-(2-methylbutyl)-4-phenylbenzoate IUPAC Name: 3-(2-methylbutyl)-4-phenylbenzoate Traditional Name: 3-(2-methylbutyl)-4-phenyl-benzoate Formula: C18H19O2- MolecularWeight: 267.34226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20O2/c1-3-13(2)11-16-12-15(18(19)20)9-10-17(16)14-7-5-4-6-8-14/h4-10,12-13H,3,11H2,1-2H3,(H,19,20)/p-1