1-(2-carbamimidoylphenyl)piperidine-3-carboxylic acid

Systemtic Name: 1-(2-carbamimidoylphenyl)piperidine-3-carboxylic acid Openeye Name: 1-(2-carbamimidoylphenyl)piperidine-3-carboxylic acid CAS Name: 1-(2-carbamimidoylphenyl)-3-piperidinecarboxylic acid IUPAC Name: 1-(2-carbamimidoylphenyl)piperidine-3-carboxylic acid Traditional Name: 1-(2-amidinophenyl)nipecotic acid Formula: C13H17N3O2 MolecularWeight: 247.29298

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC=CC=C2C(=N)N)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C2=CC=CC=C2C(=N)N)C(=O)O

InChI

InChI=1S/C13H17N3O2/c14-12(15)10-5-1-2-6-11(10)16-7-3-4-9(8-16)13(17)18/h1-2,5-6,9H,3-4,7-8H2,(H3,14,15)(H,17,18)