2-[1-(4-nitrophenyl)sulfonylbenzimidazol-2-yl]ethanenitrile

Systemtic Name: 2-[1-(4-nitrophenyl)sulfonylbenzimidazol-2-yl]ethanenitrile Openeye Name: 2-[1-(4-nitrophenyl)sulfonylbenzimidazol-2-yl]acetonitrile CAS Name: 2-[1-(4-nitrophenyl)sulfonyl-2-benzimidazolyl]acetonitrile IUPAC Name: 2-[1-(4-nitrophenyl)sulfonylbenzimidazol-2-yl]acetonitrile Traditional Name: 2-(1-nosylbenzimidazol-2-yl)acetonitrile Formula: C15H10N4O4S MolecularWeight: 342.3293

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])CC#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])CC#N

InChI

InChI=1S/C15H10N4O4S/c16-10-9-15-17-13-3-1-2-4-14(13)18(15)24(22,23)12-7-5-11(6-8-12)19(20)21/h1-8H,9H2