5-(3-carboxy-4-ethyl-phenyl)-2-ethyl-benzoic acid

Systemtic Name: 5-(3-carboxy-4-ethyl-phenyl)-2-ethyl-benzoic acid Openeye Name: 5-(3-carboxy-4-ethyl-phenyl)-2-ethyl-benzoic acid CAS Name: 5-(3-carboxy-4-ethylphenyl)-2-ethylbenzoic acid IUPAC Name: 5-(3-carboxy-4-ethylphenyl)-2-ethylbenzoic acid Traditional Name: 5-(3-carboxy-4-ethyl-phenyl)-2-ethyl-benzoic acid Formula: C18H18O4 MolecularWeight: 298.33312

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C2=CC(=C(C=C2)CC)C(=O)O)C(=O)O

Isomeric SMILES

CCC1=C(C=C(C=C1)C2=CC(=C(C=C2)CC)C(=O)O)C(=O)O

InChI

InChI=1S/C18H18O4/c1-3-11-5-7-13(9-15(11)17(19)20)14-8-6-12(4-2)16(10-14)18(21)22/h5-10H,3-4H2,1-2H3,(H,19,20)(H,21,22)