4-azanylbenzenethiol; nitrobenzene

Systemtic Name: 4-azanylbenzenethiol; nitrobenzene Openeye Name: 4-aminobenzenethiol; nitrobenzene CAS Name: 4-aminobenzenethiol; nitrobenzene IUPAC Name: 4-aminobenzenethiol; nitrobenzene Traditional Name: 4-aminobenzenethiol; nitrobenzene Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+](=O)[O-].C1=CC(=CC=C1N)S

Isomeric SMILES

C1=CC=C(C=C1)[N+](=O)[O-].C1=CC(=CC=C1N)S

InChI

InChI=1S/C6H5NO2.C6H7NS/c8-7(9)6-4-2-1-3-5-6;7-5-1-3-6(8)4-2-5/h1-5H;1-4,8H,7H2