3-[[4-[(2-chloranyl-4-nitro-phenyl)diazenyl]phenyl]-(2-hydroxyethyl)amino]propanenitrile

Systemtic Name: 3-[[4-[(2-chloranyl-4-nitro-phenyl)diazenyl]phenyl]-(2-hydroxyethyl)amino]propanenitrile Openeye Name: 3-[4-(2-chloro-4-nitro-phenyl)azo-N-(2-hydroxyethyl)anilino]propanenitrile CAS Name: 3-[4-(2-chloro-4-nitrophenyl)azo-N-(2-hydroxyethyl)anilino]propanenitrile IUPAC Name: 3-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(2-hydroxyethyl)anilino]propanenitrile Traditional Name: 3-[4-(2-chloro-4-nitro-phenyl)azo-N-(2-hydroxyethyl)anilino]propionitrile Formula: C17H16ClN5O3 MolecularWeight: 373.79364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)N(CCC#N)CCO

Isomeric SMILES

C1=CC(=CC=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)N(CCC#N)CCO

InChI

InChI=1S/C17H16ClN5O3/c18-16-12-15(23(25)26)6-7-17(16)21-20-13-2-4-14(5-3-13)22(10-11-24)9-1-8-19/h2-7,12,24H,1,9-11H2