4-[4-[2,6-bis(chloranyl)phenyl]sulfonylpiperazin-1-yl]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[4-[2,6-bis(chloranyl)phenyl]sulfonylpiperazin-1-yl]-3-nitro-benzenecarbonitrile Openeye Name: 4-[4-(2,6-dichlorophenyl)sulfonylpiperazin-1-yl]-3-nitro-benzonitrile CAS Name: 4-[4-(2,6-dichlorophenyl)sulfonyl-1-piperazinyl]-3-nitrobenzonitrile IUPAC Name: 4-[4-(2,6-dichlorophenyl)sulfonylpiperazin-1-yl]-3-nitrobenzonitrile Traditional Name: 4-[4-(2,6-dichlorophenyl)sulfonylpiperazino]-3-nitro-benzonitrile Formula: C17H14Cl2N4O4S MolecularWeight: 441.28846

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C#N)[N+](=O)[O-])S(=O)(=O)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C#N)[N+](=O)[O-])S(=O)(=O)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C17H14Cl2N4O4S/c18-13-2-1-3-14(19)17(13)28(26,27)22-8-6-21(7-9-22)15-5-4-12(11-20)10-16(15)23(24)25/h1-5,10H,6-9H2