N,N-diethyl-1-[4-nitro-2-[(E)-(phenylsulfonylhydrazinylidene)methyl]phenyl]piperidine-3-carboxamide

Systemtic Name: N,N-diethyl-1-[4-nitro-2-[(E)-(phenylsulfonylhydrazinylidene)methyl]phenyl]piperidine-3-carboxamide Openeye Name: 1-[2-[(E)-(benzenesulfonylhydrazono)methyl]-4-nitro-phenyl]-N,N-diethyl-piperidine-3-carboxamide CAS Name: 1-[2-[(E)-(benzenesulfonylhydrazinylidene)methyl]-4-nitrophenyl]-N,N-diethyl-3-piperidinecarboxamide IUPAC Name: 1-[2-[(E)-(benzenesulfonylhydrazinylidene)methyl]-4-nitrophenyl]-N,N-diethylpiperidine-3-carboxamide Traditional Name: 1-[2-[(E)-(besylhydrazono)methyl]-4-nitro-phenyl]-N,N-diethyl-nipecotamide Formula: C23H29N5O5S MolecularWeight: 487.57186

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C=NNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)C1CCCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])/C=N/NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H29N5O5S/c1-3-26(4-2)23(29)18-9-8-14-27(17-18)22-13-12-20(28(30)31)15-19(22)16-24-25-34(32,33)21-10-6-5-7-11-21/h5-7,10-13,15-16,18,25H,3-4,8-9,14,17H2,1-2H3/b24-16+