5-nitro-2-[(3-piperidin-1-ylsulfonylphenyl)amino]benzenecarbonitrile

Systemtic Name: 5-nitro-2-[(3-piperidin-1-ylsulfonylphenyl)amino]benzenecarbonitrile Openeye Name: 5-nitro-2-[3-(1-piperidylsulfonyl)anilino]benzonitrile CAS Name: 5-nitro-2-[3-(1-piperidinylsulfonyl)anilino]benzonitrile IUPAC Name: 5-nitro-2-(3-piperidin-1-ylsulfonylanilino)benzonitrile Traditional Name: 5-nitro-2-(3-piperidinosulfonylanilino)benzonitrile Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H18N4O4S/c19-13-14-11-16(22(23)24)7-8-18(14)20-15-5-4-6-17(12-15)27(25,26)21-9-2-1-3-10-21/h4-8,11-12,20H,1-3,9-10H2