(E,4S)-4-azanyl-4-methyl-2,5-bis(oxidanyl)-5-oxidanylidene-pent-1-ene-1-diazonium

Systemtic Name: (E,4S)-4-azanyl-4-methyl-2,5-bis(oxidanyl)-5-oxidanylidene-pent-1-ene-1-diazonium Openeye Name: (E,4S)-4-amino-2,5-dihydroxy-4-methyl-5-oxo-pent-1-ene-1-diazonium CAS Name: (E,4S)-4-amino-2,5-dihydroxy-4-methyl-5-oxo-1-pentene-1-diazonium IUPAC Name: (E,4S)-4-amino-2,5-dihydroxy-4-methyl-5-oxopent-1-ene-1-diazonium Traditional Name: (E,4S)-4-amino-2,5-dihydroxy-5-keto-4-methyl-pent-1-ene-1-diazonium Formula: C6H10N3O3+ MolecularWeight: 172.1619

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=C[N+]#N)O)(C(=O)O)N

Isomeric SMILES

C[C@](C/C(=C\[N+]#N)/O)(C(=O)O)N

InChI

InChI=1S/C6H9N3O3/c1-6(7,5(11)12)2-4(10)3-9-8/h3H,2,7H2,1H3,(H-,10,11,12)/p+1/b4-3+/t6-/m0/s1