4-(4-carboxylatophenyl)-2,3-diethyl-benzoate

Systemtic Name: 4-(4-carboxylatophenyl)-2,3-diethyl-benzoate Openeye Name: 4-(4-carboxylatophenyl)-2,3-diethyl-benzoate CAS Name: 4-(4-carboxylatophenyl)-2,3-diethylbenzoate IUPAC Name: 4-(4-carboxylatophenyl)-2,3-diethylbenzoate Traditional Name: 4-(4-carboxylatophenyl)-2,3-diethyl-benzoate Formula: C18H16O4-2 MolecularWeight: 296.31724

Click to see the large picture

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)/p-2