(2S)-2-azanylpentanedioic acid; chromium(3+); pyridine-3-carboxylate

Systemtic Name: (2S)-2-azanylpentanedioic acid; chromium(3+); pyridine-3-carboxylate Openeye Name: chromic; (2S)-2-aminopentanedioic acid; pyridine-3-carboxylate CAS Name: (2S)-2-aminopentanedioic acid; chromium(3+); 3-pyridinecarboxylate IUPAC Name: (2S)-2-aminopentanedioic acid; chromium(3+); pyridine-3-carboxylate Traditional Name: chromic; (2S)-2-aminoglutaric acid; nicotinate Formula: C17H17CrN3O8+ MolecularWeight: 443.32828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)[O-].C1=CC(=CN=C1)C(=O)[O-].C(CC(=O)O)C(C(=O)O)N.[Cr+3]

Isomeric SMILES

C1=CC(=CN=C1)C(=O)[O-].C1=CC(=CN=C1)C(=O)[O-].C(CC(=O)O)[C@@H](C(=O)O)N.[Cr+3]

InChI

InChI=1S/2C6H5NO2.C5H9NO4.Cr/c2*8-6(9)5-2-1-3-7-4-5;6-3(5(9)10)1-2-4(7)8;/h2*1-4H,(H,8,9);3H,1-2,6H2,(H,7,8)(H,9,10);/q;;;+3/p-2/t;;3-;/m..0./s1