N,N-bis[3-(dimethylamino)propyl]-4-(1,3-diphenylpropan-2-ylamino)-3-nitro-benzenesulfonamide

Systemtic Name: N,N-bis[3-(dimethylamino)propyl]-4-(1,3-diphenylpropan-2-ylamino)-3-nitro-benzenesulfonamide Openeye Name: 4-[(1-benzyl-2-phenyl-ethyl)amino]-N,N-bis[3-(dimethylamino)propyl]-3-nitro-benzenesulfonamide CAS Name: N,N-bis[3-(dimethylamino)propyl]-4-(1,3-diphenylpropan-2-ylamino)-3-nitrobenzenesulfonamide IUPAC Name: N,N-bis[3-(dimethylamino)propyl]-4-(1,3-diphenylpropan-2-ylamino)-3-nitrobenzenesulfonamide Traditional Name: 4-[(1-benzyl-2-phenyl-ethyl)amino]-N,N-bis[3-(dimethylamino)propyl]-3-nitro-benzenesulfonamide Formula: C31H43N5O4S MolecularWeight: 581.76922

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(CCCN(C)C)S(=O)(=O)C1=CC(=C(C=C1)NC(CC2=CC=CC=C2)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCN(CCCN(C)C)S(=O)(=O)C1=CC(=C(C=C1)NC(CC2=CC=CC=C2)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C31H43N5O4S/c1-33(2)19-11-21-35(22-12-20-34(3)4)41(39,40)29-17-18-30(31(25-29)36(37)38)32-28(23-26-13-7-5-8-14-26)24-27-15-9-6-10-16-27/h5-10,13-18,25,28,32H,11-12,19-24H2,1-4H3