N,N-bis[3-(dimethylamino)propyl]-4-(2,2-diphenylethylamino)-3-nitro-benzenesulfonamide

Systemtic Name: N,N-bis[3-(dimethylamino)propyl]-4-(2,2-diphenylethylamino)-3-nitro-benzenesulfonamide Openeye Name: N,N-bis[3-(dimethylamino)propyl]-4-(2,2-diphenylethylamino)-3-nitro-benzenesulfonamide CAS Name: N,N-bis[3-(dimethylamino)propyl]-4-(2,2-diphenylethylamino)-3-nitrobenzenesulfonamide IUPAC Name: N,N-bis[3-(dimethylamino)propyl]-4-(2,2-diphenylethylamino)-3-nitrobenzenesulfonamide Traditional Name: N,N-bis[3-(dimethylamino)propyl]-4-(2,2-diphenylethylamino)-3-nitro-benzenesulfonamide Formula: C30H41N5O4S MolecularWeight: 567.74264

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(CCCN(C)C)S(=O)(=O)C1=CC(=C(C=C1)NCC(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCN(CCCN(C)C)S(=O)(=O)C1=CC(=C(C=C1)NCC(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C30H41N5O4S/c1-32(2)19-11-21-34(22-12-20-33(3)4)40(38,39)27-17-18-29(30(23-27)35(36)37)31-24-28(25-13-7-5-8-14-25)26-15-9-6-10-16-26/h5-10,13-18,23,28,31H,11-12,19-22,24H2,1-4H3