2-[1-(phenylmethyl)piperidin-4-yl]propanedioic acid

Systemtic Name: 2-[1-(phenylmethyl)piperidin-4-yl]propanedioic acid Openeye Name: 2-(1-benzyl-4-piperidyl)propanedioic acid CAS Name: 2-[1-(phenylmethyl)-4-piperidinyl]propanedioic acid IUPAC Name: 2-(1-benzylpiperidin-4-yl)propanedioic acid Traditional Name: 2-(1-benzyl-4-piperidyl)malonic acid Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(C(=O)O)C(=O)O)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCC1C(C(=O)O)C(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C15H19NO4/c17-14(18)13(15(19)20)12-6-8-16(9-7-12)10-11-4-2-1-3-5-11/h1-5,12-13H,6-10H2,(H,17,18)(H,19,20)