N-[(2-chloranyl-5-nitro-phenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-N-methyl-piperidine-3-carboxamide

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-N-methyl-piperidine-3-carboxamide Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-N-methyl-piperidine-3-carboxamide CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-N-methyl-3-piperidinecarboxamide IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-N-methylpiperidine-3-carboxamide Traditional Name: N-(2-chloro-5-nitro-benzyl)-1-(4-methoxyphenyl)sulfonyl-N-methyl-nipecotamide Formula: C21H24ClN3O6S MolecularWeight: 481.94976

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24ClN3O6S/c1-23(13-16-12-17(25(27)28)5-10-20(16)22)21(26)15-4-3-11-24(14-15)32(29,30)19-8-6-18(31-2)7-9-19/h5-10,12,15H,3-4,11,13-14H2,1-2H3