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4-pyridin-4-ylheptanedioic acid

4-pyridin-4-ylheptanedioic acid

Systemtic Name:4-pyridin-4-ylheptanedioic acid
Openeye Name:4-(4-pyridyl)heptanedioic acid
CAS Name:4-pyridin-4-ylheptanedioic acid
IUPAC Name:4-pyridin-4-ylheptanedioic acid
Traditional Name:4-(4-pyridyl)pimelic acid
Formula: C12H15NO4
MolecularWeight: 237.2518
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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C(CCC(=O)O)CCC(=O)O


Isomeric SMILES

C1=CN=CC=C1C(CCC(=O)O)CCC(=O)O


InChI

InChI=1S/C12H15NO4/c14-11(15)3-1-9(2-4-12(16)17)10-5-7-13-8-6-10/h5-9H,1-4H2,(H,14,15)(H,16,17)


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