2-azanyl-2-(2-cyanoethyl)-3,6-bis(oxidanylidene)hexanoic acid

Systemtic Name: 2-azanyl-2-(2-cyanoethyl)-3,6-bis(oxidanylidene)hexanoic acid Openeye Name: 2-amino-2-(2-cyanoethyl)-3,6-dioxo-hexanoic acid CAS Name: 2-amino-2-(2-cyanoethyl)-3,6-dioxohexanoic acid IUPAC Name: 2-amino-2-(2-cyanoethyl)-3,6-dioxohexanoic acid Traditional Name: 2-amino-2-(2-cyanoethyl)-3,6-diketo-hexanoic acid Formula: C9H12N2O4 MolecularWeight: 212.20258

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)C(CCC#N)(C(=O)O)N)C=O

Isomeric SMILES

C(CC(=O)C(CCC#N)(C(=O)O)N)C=O

InChI

InChI=1S/C9H12N2O4/c10-5-2-4-9(11,8(14)15)7(13)3-1-6-12/h6H,1-4,11H2,(H,14,15)