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2-[(3-carboxyphenyl)methyl]butanedioic acid

2-[(3-carboxyphenyl)methyl]butanedioic acid

Systemtic Name:2-[(3-carboxyphenyl)methyl]butanedioic acid
Openeye Name:2-[(3-carboxyphenyl)methyl]butanedioic acid
CAS Name:2-[(3-carboxyphenyl)methyl]butanedioic acid
IUPAC Name:2-[(3-carboxyphenyl)methyl]butanedioic acid
Traditional Name:2-(3-carboxybenzyl)succinic acid
Formula: C12H12O6
MolecularWeight: 252.22008
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CC(CC(=O)O)C(=O)O)C(=O)O


Isomeric SMILES

C1=CC(=CC(=C1)CC(CC(=O)O)C(=O)O)C(=O)O


InChI

InChI=1S/C12H12O6/c13-10(14)6-9(12(17)18)5-7-2-1-3-8(4-7)11(15)16/h1-4,9H,5-6H2,(H,13,14)(H,15,16)(H,17,18)


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