2-ethyl-3-(phenylmethyl)butanedioic acid

Systemtic Name: 2-ethyl-3-(phenylmethyl)butanedioic acid Openeye Name: 2-benzyl-3-ethyl-butanedioic acid CAS Name: 2-ethyl-3-(phenylmethyl)butanedioic acid IUPAC Name: 2-benzyl-3-ethylbutanedioic acid Traditional Name: 2-benzyl-3-ethyl-succinic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC1=CC=CC=C1)C(=O)O)C(=O)O

Isomeric SMILES

CCC(C(CC1=CC=CC=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C13H16O4/c1-2-10(12(14)15)11(13(16)17)8-9-6-4-3-5-7-9/h3-7,10-11H,2,8H2,1H3,(H,14,15)(H,16,17)