1-nitro-2-[4-(1-oxidanylidenepropan-2-ylamino)phenyl]guanidine

Systemtic Name: 1-nitro-2-[4-(1-oxidanylidenepropan-2-ylamino)phenyl]guanidine Openeye Name: 2-[4-[(1-methyl-2-oxo-ethyl)amino]phenyl]-1-nitro-guanidine CAS Name: 1-nitro-2-[4-(1-oxopropan-2-ylamino)phenyl]guanidine IUPAC Name: 1-nitro-2-[4-(1-oxopropan-2-ylamino)phenyl]guanidine Traditional Name: 2-[4-[(2-keto-1-methyl-ethyl)amino]phenyl]-1-nitro-guanidine Formula: C10H13N5O3 MolecularWeight: 251.24192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=O)NC1=CC=C(C=C1)N=C(N)N[N+](=O)[O-]

Isomeric SMILES

CC(C=O)NC1=CC=C(C=C1)N=C(N)N[N+](=O)[O-]

InChI

InChI=1S/C10H13N5O3/c1-7(6-16)12-8-2-4-9(5-3-8)13-10(11)14-15(17)18/h2-7,12H,1H3,(H3,11,13,14)