2-[[4-[bis(2-hydroxyethyl)amino]-2-nitro-5-propan-2-ylsulfanyl-phenyl]amino]ethanol

Systemtic Name: 2-[[4-[bis(2-hydroxyethyl)amino]-2-nitro-5-propan-2-ylsulfanyl-phenyl]amino]ethanol Openeye Name: 2-[4-[bis(2-hydroxyethyl)amino]-5-isopropylsulfanyl-2-nitro-anilino]ethanol CAS Name: 2-[4-[bis(2-hydroxyethyl)amino]-2-nitro-5-(propan-2-ylthio)anilino]ethanol IUPAC Name: 2-[4-[bis(2-hydroxyethyl)amino]-2-nitro-5-propan-2-ylsulfanylanilino]ethanol Traditional Name: 2-[4-[bis(2-hydroxyethyl)amino]-5-(isopropylthio)-2-nitro-anilino]ethanol Formula: C15H25N3O5S MolecularWeight: 359.4411

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC(=C(C=C1N(CCO)CCO)[N+](=O)[O-])NCCO

Isomeric SMILES

CC(C)SC1=CC(=C(C=C1N(CCO)CCO)[N+](=O)[O-])NCCO

InChI

InChI=1S/C15H25N3O5S/c1-11(2)24-15-9-12(16-3-6-19)13(18(22)23)10-14(15)17(4-7-20)5-8-21/h9-11,16,19-21H,3-8H2,1-2H3