3-(3-azanylpropylcarbamoyl)pyrazine-2-carboxylic acid

Systemtic Name: 3-(3-azanylpropylcarbamoyl)pyrazine-2-carboxylic acid Openeye Name: 3-(3-aminopropylcarbamoyl)pyrazine-2-carboxylic acid CAS Name: 3-[(3-aminopropylamino)-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-(3-aminopropylcarbamoyl)pyrazine-2-carboxylic acid Traditional Name: 3-(3-aminopropylcarbamoyl)pyrazinoic acid Formula: C9H12N4O3 MolecularWeight: 224.21658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C(=N1)C(=O)NCCCN)C(=O)O

Isomeric SMILES

C1=CN=C(C(=N1)C(=O)NCCCN)C(=O)O

InChI

InChI=1S/C9H12N4O3/c10-2-1-3-13-8(14)6-7(9(15)16)12-5-4-11-6/h4-5H,1-3,10H2,(H,13,14)(H,15,16)