1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-ethyl-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-ethyl-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-(2-chloro-5-nitro-phenyl)sulfonyl-N-ethyl-piperidine-4-carboxamide CAS Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-ethyl-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-(2-chloro-5-nitrophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide Traditional Name: N-benzyl-1-(2-chloro-5-nitro-phenyl)sulfonyl-N-ethyl-isonipecotamide Formula: C21H24ClN3O5S MolecularWeight: 465.95036

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H24ClN3O5S/c1-2-23(15-16-6-4-3-5-7-16)21(26)17-10-12-24(13-11-17)31(29,30)20-14-18(25(27)28)8-9-19(20)22/h3-9,14,17H,2,10-13,15H2,1H3