2-[bis(azanyl)methylideneamino]-3-phenyl-propanoic acid; piperidine-4-carboxylic acid

Systemtic Name: 2-[bis(azanyl)methylideneamino]-3-phenyl-propanoic acid; piperidine-4-carboxylic acid Openeye Name: 2-guanidino-3-phenyl-propanoic acid; piperidine-4-carboxylic acid CAS Name: 2-(diaminomethylideneamino)-3-phenylpropanoic acid; 4-piperidinecarboxylic acid IUPAC Name: 2-(diaminomethylideneamino)-3-phenylpropanoic acid; piperidine-4-carboxylic acid Traditional Name: 2-guanidino-3-phenyl-propionic acid; isonipecotic acid Formula: C16H24N4O4 MolecularWeight: 336.38616

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(=O)O.C1=CC=C(C=C1)CC(C(=O)O)N=C(N)N

Isomeric SMILES

C1CNCCC1C(=O)O.C1=CC=C(C=C1)CC(C(=O)O)N=C(N)N

InChI

InChI=1S/C10H13N3O2.C6H11NO2/c11-10(12)13-8(9(14)15)6-7-4-2-1-3-5-7;8-6(9)5-1-3-7-4-2-5/h1-5,8H,6H2,(H,14,15)(H4,11,12,13);5,7H,1-4H2,(H,8,9)