2-[[4-[(3,5-dinitrothiophen-2-yl)diazenyl]-3-methyl-phenyl]-(2-hydroxyethyl)amino]ethanol

Systemtic Name: 2-[[4-[(3,5-dinitrothiophen-2-yl)diazenyl]-3-methyl-phenyl]-(2-hydroxyethyl)amino]ethanol Openeye Name: 2-[4-[(3,5-dinitro-2-thienyl)azo]-N-(2-hydroxyethyl)-3-methyl-anilino]ethanol CAS Name: 2-[4-[(3,5-dinitro-2-thiophenyl)azo]-N-(2-hydroxyethyl)-3-methylanilino]ethanol IUPAC Name: 2-[4-[(3,5-dinitrothiophen-2-yl)diazenyl]-N-(2-hydroxyethyl)-3-methylanilino]ethanol Traditional Name: 2-[4-[(3,5-dinitro-2-thienyl)azo]-N-(2-hydroxyethyl)-3-methyl-anilino]ethanol Formula: C15H17N5O6S MolecularWeight: 395.39038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=C(C=C(S2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=C(C=C(S2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O6S/c1-10-8-11(18(4-6-21)5-7-22)2-3-12(10)16-17-15-13(19(23)24)9-14(27-15)20(25)26/h2-3,8-9,21-22H,4-7H2,1H3