2-(3-azanyl-2-nitro-5-phenylsulfanyl-phenoxy)benzenecarbonitrile

Systemtic Name: 2-(3-azanyl-2-nitro-5-phenylsulfanyl-phenoxy)benzenecarbonitrile Openeye Name: 2-(3-amino-2-nitro-5-phenylsulfanyl-phenoxy)benzonitrile CAS Name: 2-[3-amino-2-nitro-5-(phenylthio)phenoxy]benzonitrile IUPAC Name: 2-(3-amino-2-nitro-5-phenylsulfanylphenoxy)benzonitrile Traditional Name: 2-[3-amino-2-nitro-5-(phenylthio)phenoxy]benzonitrile Formula: C19H13N3O3S MolecularWeight: 363.38982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC(=C(C(=C2)N)[N+](=O)[O-])OC3=CC=CC=C3C#N

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC(=C(C(=C2)N)[N+](=O)[O-])OC3=CC=CC=C3C#N

InChI

InChI=1S/C19H13N3O3S/c20-12-13-6-4-5-9-17(13)25-18-11-15(10-16(21)19(18)22(23)24)26-14-7-2-1-3-8-14/h1-11H,21H2