N-[2-[(2-cyano-4-nitro-phenyl)diazenyl]-5-[(phenylmethyl)amino]phenyl]ethanamide

Systemtic Name: N-[2-[(2-cyano-4-nitro-phenyl)diazenyl]-5-[(phenylmethyl)amino]phenyl]ethanamide Openeye Name: N-[5-(benzylamino)-2-(2-cyano-4-nitro-phenyl)azo-phenyl]acetamide CAS Name: N-[2-(2-cyano-4-nitrophenyl)azo-5-[(phenylmethyl)amino]phenyl]acetamide IUPAC Name: N-[5-(benzylamino)-2-[(2-cyano-4-nitrophenyl)diazenyl]phenyl]acetamide Traditional Name: N-[5-(benzylamino)-2-(2-cyano-4-nitro-phenyl)azo-phenyl]acetamide Formula: C22H18N6O3 MolecularWeight: 414.41672

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NCC2=CC=CC=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NCC2=CC=CC=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C22H18N6O3/c1-15(29)25-22-12-18(24-14-16-5-3-2-4-6-16)7-9-21(22)27-26-20-10-8-19(28(30)31)11-17(20)13-23/h2-12,24H,14H2,1H3,(H,25,29)