2-[4-[(4-methyl-3-nitro-phenyl)sulfonylamino]phenyl]-1-nitro-guanidine

Systemtic Name: 2-[4-[(4-methyl-3-nitro-phenyl)sulfonylamino]phenyl]-1-nitro-guanidine Openeye Name: 2-[4-[(4-methyl-3-nitro-phenyl)sulfonylamino]phenyl]-1-nitro-guanidine CAS Name: 2-[4-[(4-methyl-3-nitrophenyl)sulfonylamino]phenyl]-1-nitroguanidine IUPAC Name: 2-[4-[(4-methyl-3-nitrophenyl)sulfonylamino]phenyl]-1-nitroguanidine Traditional Name: 2-[4-[(4-methyl-3-nitro-phenyl)sulfonylamino]phenyl]-1-nitro-guanidine Formula: C14H14N6O6S MolecularWeight: 394.36256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N=C(N)N[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N=C(N)N[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H14N6O6S/c1-9-2-7-12(8-13(9)19(21)22)27(25,26)18-11-5-3-10(4-6-11)16-14(15)17-20(23)24/h2-8,18H,1H3,(H3,15,16,17)