2-[[4-[bis(2-hydroxyethyl)amino]phenyl]diazenyl]-5-nitro-benzene-1,3-dicarbonitrile

Systemtic Name: 2-[[4-[bis(2-hydroxyethyl)amino]phenyl]diazenyl]-5-nitro-benzene-1,3-dicarbonitrile Openeye Name: 2-[4-[bis(2-hydroxyethyl)amino]phenyl]azo-5-nitro-benzene-1,3-dicarbonitrile CAS Name: 2-[4-[bis(2-hydroxyethyl)amino]phenyl]azo-5-nitrobenzene-1,3-dicarbonitrile IUPAC Name: 2-[[4-[bis(2-hydroxyethyl)amino]phenyl]diazenyl]-5-nitrobenzene-1,3-dicarbonitrile Traditional Name: 2-[4-[bis(2-hydroxyethyl)amino]phenyl]azo-5-nitro-isophthalonitrile Formula: C18H16N6O4 MolecularWeight: 380.35744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])C#N)N(CCO)CCO

Isomeric SMILES

C1=CC(=CC=C1N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])C#N)N(CCO)CCO

InChI

InChI=1S/C18H16N6O4/c19-11-13-9-17(24(27)28)10-14(12-20)18(13)22-21-15-1-3-16(4-2-15)23(5-7-25)6-8-26/h1-4,9-10,25-26H,5-8H2