2-(1-butylpiperidin-4-yl)propanedioic acid

Systemtic Name: 2-(1-butylpiperidin-4-yl)propanedioic acid Openeye Name: 2-(1-butyl-4-piperidyl)propanedioic acid CAS Name: 2-(1-butyl-4-piperidinyl)propanedioic acid IUPAC Name: 2-(1-butylpiperidin-4-yl)propanedioic acid Traditional Name: 2-(1-butyl-4-piperidyl)malonic acid Formula: C12H21NO4 MolecularWeight: 243.29944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)C(C(=O)O)C(=O)O

Isomeric SMILES

CCCCN1CCC(CC1)C(C(=O)O)C(=O)O

InChI

InChI=1S/C12H21NO4/c1-2-3-6-13-7-4-9(5-8-13)10(11(14)15)12(16)17/h9-10H,2-8H2,1H3,(H,14,15)(H,16,17)