4-(4-carboxyphenyl)-2,3-diethyl-benzoic acid

Systemtic Name: 4-(4-carboxyphenyl)-2,3-diethyl-benzoic acid Openeye Name: 4-(4-carboxyphenyl)-2,3-diethyl-benzoic acid CAS Name: 4-(4-carboxyphenyl)-2,3-diethylbenzoic acid IUPAC Name: 4-(4-carboxyphenyl)-2,3-diethylbenzoic acid Traditional Name: 4-(4-carboxyphenyl)-2,3-diethyl-benzoic acid Formula: C18H18O4 MolecularWeight: 298.33312

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1CC)C(=O)O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC1=C(C=CC(=C1CC)C(=O)O)C2=CC=C(C=C2)C(=O)O

InChI

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