5-[4-(3-carboxy-4-nonoxy-phenyl)phenyl]-2-methyl-benzoic acid

Systemtic Name: 5-[4-(3-carboxy-4-nonoxy-phenyl)phenyl]-2-methyl-benzoic acid Openeye Name: 5-[4-(3-carboxy-4-nonoxy-phenyl)phenyl]-2-methyl-benzoic acid CAS Name: 5-[4-(3-carboxy-4-nonoxyphenyl)phenyl]-2-methylbenzoic acid IUPAC Name: 5-[4-(3-carboxy-4-nonoxyphenyl)phenyl]-2-methylbenzoic acid Traditional Name: 5-[4-(3-carboxy-4-nonoxy-phenyl)phenyl]-2-methyl-benzoic acid Formula: C30H34O5 MolecularWeight: 474.58796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)C3=CC(=C(C=C3)C)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)C3=CC(=C(C=C3)C)C(=O)O)C(=O)O

InChI

InChI=1S/C30H34O5/c1-3-4-5-6-7-8-9-18-35-28-17-16-25(20-27(28)30(33)34)23-14-12-22(13-15-23)24-11-10-21(2)26(19-24)29(31)32/h10-17,19-20H,3-9,18H2,1-2H3,(H,31,32)(H,33,34)