4-[[(Z,2Z)-4-ethyl-2-hydroxyimino-5-nitro-hex-3-enoyl]amino]butanoic acid

Systemtic Name: 4-[[(Z,2Z)-4-ethyl-2-hydroxyimino-5-nitro-hex-3-enoyl]amino]butanoic acid Openeye Name: 4-[[(Z,2Z)-4-ethyl-2-hydroxyimino-5-nitro-hex-3-enoyl]amino]butanoic acid CAS Name: 4-[[(Z,2Z)-4-ethyl-2-hydroxyimino-5-nitro-1-oxohex-3-enyl]amino]butanoic acid IUPAC Name: 4-[[(Z,2Z)-4-ethyl-2-hydroxyimino-5-nitrohex-3-enoyl]amino]butanoic acid Traditional Name: 4-[[(Z,2Z)-4-ethyl-2-hydroximino-5-nitro-hex-3-enoyl]amino]butyric acid Formula: C12H19N3O6 MolecularWeight: 301.29576

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC(=NO)C(=O)NCCCC(=O)O)C(C)[N+](=O)[O-]

Isomeric SMILES

CC/C(=C/C(=N/O)/C(=O)NCCCC(=O)O)/C(C)[N+](=O)[O-]

InChI

InChI=1S/C12H19N3O6/c1-3-9(8(2)15(20)21)7-10(14-19)12(18)13-6-4-5-11(16)17/h7-8,19H,3-6H2,1-2H3,(H,13,18)(H,16,17)/b9-7-,14-10-