5-nitro-2-[2-(phenylsulfonyl)ethylamino]benzenecarbonitrile

Systemtic Name: 5-nitro-2-[2-(phenylsulfonyl)ethylamino]benzenecarbonitrile Openeye Name: 2-[2-(benzenesulfonyl)ethylamino]-5-nitro-benzonitrile CAS Name: 2-[2-(benzenesulfonyl)ethylamino]-5-nitrobenzonitrile IUPAC Name: 2-[2-(benzenesulfonyl)ethylamino]-5-nitrobenzonitrile Traditional Name: 2-(2-besylethylamino)-5-nitro-benzonitrile Formula: C15H13N3O4S MolecularWeight: 331.34642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCNC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCNC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H13N3O4S/c16-11-12-10-13(18(19)20)6-7-15(12)17-8-9-23(21,22)14-4-2-1-3-5-14/h1-7,10,17H,8-9H2