4-methyl-2-nitro-aniline; (sulfinoamino)methane

Systemtic Name: 4-methyl-2-nitro-aniline; (sulfinoamino)methane Openeye Name: 4-methyl-2-nitro-aniline; (sulfinoamino)methane CAS Name: 4-methyl-2-nitroaniline; (sulfinoamino)methane IUPAC Name: 4-methyl-2-nitroaniline; (sulfinoamino)methane Traditional Name: (4-methyl-2-nitro-phenyl)amine; (sulfinoamino)methane Formula: C8H13N3O4S MolecularWeight: 247.27152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N)[N+](=O)[O-].CNS(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)N)[N+](=O)[O-].CNS(=O)O

InChI

InChI=1S/C7H8N2O2.CH5NO2S/c1-5-2-3-6(8)7(4-5)9(10)11;1-2-5(3)4/h2-4H,8H2,1H3;2H,1H3,(H,3,4)