(E)-2-azanyl-6-(1-azanylethylideneamino)-4-fluoranyl-2-methyl-hex-4-enoic acid

Systemtic Name: (E)-2-azanyl-6-(1-azanylethylideneamino)-4-fluoranyl-2-methyl-hex-4-enoic acid Openeye Name: (E)-2-amino-6-(1-aminoethylideneamino)-4-fluoro-2-methyl-hex-4-enoic acid CAS Name: (E)-2-amino-6-(1-aminoethylideneamino)-4-fluoro-2-methyl-4-hexenoic acid IUPAC Name: (E)-2-amino-6-(1-aminoethylideneamino)-4-fluoro-2-methylhex-4-enoic acid Traditional Name: (E)-2-amino-6-(1-aminoethylideneamino)-4-fluoro-2-methyl-hex-4-enoic acid Formula: C9H16FN3O2 MolecularWeight: 217.240643

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCC=C(CC(C)(C(=O)O)N)F)N

Isomeric SMILES

CC(=NC/C=C(\CC(C)(C(=O)O)N)/F)N

InChI

InChI=1S/C9H16FN3O2/c1-6(11)13-4-3-7(10)5-9(2,12)8(14)15/h3H,4-5,12H2,1-2H3,(H2,11,13)(H,14,15)/b7-3+