1-(4-chloranyl-3-nitro-phenyl)sulfonyl-N,N-bis[3-(dimethylamino)propyl]piperidine-2-carboxamide

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)sulfonyl-N,N-bis[3-(dimethylamino)propyl]piperidine-2-carboxamide Openeye Name: 1-(4-chloro-3-nitro-phenyl)sulfonyl-N,N-bis[3-(dimethylamino)propyl]piperidine-2-carboxamide CAS Name: 1-(4-chloro-3-nitrophenyl)sulfonyl-N,N-bis[3-(dimethylamino)propyl]-2-piperidinecarboxamide IUPAC Name: 1-(4-chloro-3-nitrophenyl)sulfonyl-N,N-bis[3-(dimethylamino)propyl]piperidine-2-carboxamide Traditional Name: 1-(4-chloro-3-nitro-phenyl)sulfonyl-N,N-bis[3-(dimethylamino)propyl]pipecolinamide Formula: C22H36ClN5O5S MolecularWeight: 518.06974

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(CCCN(C)C)C(=O)C1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCN(CCCN(C)C)C(=O)C1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H36ClN5O5S/c1-24(2)12-7-14-26(15-8-13-25(3)4)22(29)20-9-5-6-16-27(20)34(32,33)18-10-11-19(23)21(17-18)28(30)31/h10-11,17,20H,5-9,12-16H2,1-4H3