2-[[methyl(phenylsulfonyl)amino]methyl]-1-nitro-guanidine

Systemtic Name: 2-[[methyl(phenylsulfonyl)amino]methyl]-1-nitro-guanidine Openeye Name: 2-[[benzenesulfonyl(methyl)amino]methyl]-1-nitro-guanidine CAS Name: 2-[[benzenesulfonyl(methyl)amino]methyl]-1-nitroguanidine IUPAC Name: 2-[[benzenesulfonyl(methyl)amino]methyl]-1-nitroguanidine Traditional Name: 2-[[besyl(methyl)amino]methyl]-1-nitro-guanidine Formula: C9H13N5O4S MolecularWeight: 287.29562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN(C/N=C(/N)\N[N+](=O)[O-])S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C9H13N5O4S/c1-13(7-11-9(10)12-14(15)16)19(17,18)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H3,10,11,12)