N-[2-[(2,6-dicyano-4-nitro-phenyl)diazenyl]-5-(dipropylamino)phenyl]methanesulfonamide

Systemtic Name: N-[2-[(2,6-dicyano-4-nitro-phenyl)diazenyl]-5-(dipropylamino)phenyl]methanesulfonamide Openeye Name: N-[2-(2,6-dicyano-4-nitro-phenyl)azo-5-(dipropylamino)phenyl]methanesulfonamide CAS Name: N-[2-(2,6-dicyano-4-nitrophenyl)azo-5-(dipropylamino)phenyl]methanesulfonamide IUPAC Name: N-[2-[(2,6-dicyano-4-nitrophenyl)diazenyl]-5-(dipropylamino)phenyl]methanesulfonamide Traditional Name: N-[2-(2,6-dicyano-4-nitro-phenyl)azo-5-(dipropylamino)phenyl]methanesulfonamide Formula: C21H23N7O4S MolecularWeight: 469.51682

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])C#N)NS(=O)(=O)C

Isomeric SMILES

CCCN(CCC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])C#N)NS(=O)(=O)C

InChI

InChI=1S/C21H23N7O4S/c1-4-8-27(9-5-2)17-6-7-19(20(12-17)26-33(3,31)32)24-25-21-15(13-22)10-18(28(29)30)11-16(21)14-23/h6-7,10-12,26H,4-5,8-9H2,1-3H3