4-(3-phenylpropoxy)benzene-1,3-dicarboxylic acid

Systemtic Name: 4-(3-phenylpropoxy)benzene-1,3-dicarboxylic acid Openeye Name: 4-(3-phenylpropoxy)benzene-1,3-dicarboxylic acid CAS Name: 4-(3-phenylpropoxy)benzene-1,3-dicarboxylic acid IUPAC Name: 4-(3-phenylpropoxy)benzene-1,3-dicarboxylic acid Traditional Name: 4-(3-phenylpropoxy)isophthalic acid Formula: C17H16O5 MolecularWeight: 300.30594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=C(C=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C17H16O5/c18-16(19)13-8-9-15(14(11-13)17(20)21)22-10-4-7-12-5-2-1-3-6-12/h1-3,5-6,8-9,11H,4,7,10H2,(H,18,19)(H,20,21)