1-(4-chloranyl-3-nitro-phenyl)sulfonyl-N,N-bis[3-(dimethylamino)propyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)sulfonyl-N,N-bis[3-(dimethylamino)propyl]piperidine-3-carboxamide Openeye Name: 1-(4-chloro-3-nitro-phenyl)sulfonyl-N,N-bis[3-(dimethylamino)propyl]piperidine-3-carboxamide CAS Name: 1-(4-chloro-3-nitrophenyl)sulfonyl-N,N-bis[3-(dimethylamino)propyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-chloro-3-nitrophenyl)sulfonyl-N,N-bis[3-(dimethylamino)propyl]piperidine-3-carboxamide Traditional Name: 1-(4-chloro-3-nitro-phenyl)sulfonyl-N,N-bis[3-(dimethylamino)propyl]nipecotamide Formula: C22H36ClN5O5S MolecularWeight: 518.06974

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(CCCN(C)C)C(=O)C1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCN(CCCN(C)C)C(=O)C1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H36ClN5O5S/c1-24(2)11-6-13-26(14-7-12-25(3)4)22(29)18-8-5-15-27(17-18)34(32,33)19-9-10-20(23)21(16-19)28(30)31/h9-10,16,18H,5-8,11-15,17H2,1-4H3