2-(3-azanyl-4-nitro-thiophen-2-yl)-3,5-dimethyl-phenol

Systemtic Name: 2-(3-azanyl-4-nitro-thiophen-2-yl)-3,5-dimethyl-phenol Openeye Name: 2-(3-amino-4-nitro-2-thienyl)-3,5-dimethyl-phenol CAS Name: 2-(3-amino-4-nitro-2-thiophenyl)-3,5-dimethylphenol IUPAC Name: 2-(3-amino-4-nitrothiophen-2-yl)-3,5-dimethylphenol Traditional Name: 2-(3-amino-4-nitro-2-thienyl)-3,5-dimethyl-phenol Formula: C12H12N2O3S MolecularWeight: 264.30028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)O)C2=C(C(=CS2)[N+](=O)[O-])N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)O)C2=C(C(=CS2)[N+](=O)[O-])N)C

InChI

InChI=1S/C12H12N2O3S/c1-6-3-7(2)10(9(15)4-6)12-11(13)8(5-18-12)14(16)17/h3-5,15H,13H2,1-2H3