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

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)sulfonyl-N-[4-(diethylamino)phenyl]piperidine-4-carboxamide Openeye Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-[4-(diethylamino)phenyl]piperidine-4-carboxamide CAS Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-[4-(diethylamino)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-chloro-5-nitrophenyl)sulfonyl-N-[4-(diethylamino)phenyl]piperidine-4-carboxamide Traditional Name: 1-(2-chloro-5-nitro-phenyl)sulfonyl-N-[4-(diethylamino)phenyl]isonipecotamide Formula: C22H27ClN4O5S MolecularWeight: 494.99158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClN4O5S/c1-3-25(4-2)18-7-5-17(6-8-18)24-22(28)16-11-13-26(14-12-16)33(31,32)21-15-19(27(29)30)9-10-20(21)23/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,24,28)