3-[[5-[(4-tert-butylphenyl)carbonylamino]-2-(dimethylamino)phenyl]carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[5-[(4-tert-butylphenyl)carbonylamino]-2-(dimethylamino)phenyl]carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[[5-[(4-tert-butylbenzoyl)amino]-2-(dimethylamino)benzoyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[5-[[(4-tert-butylphenyl)-oxomethyl]amino]-2-(dimethylamino)phenyl]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[5-[(4-tert-butylbenzoyl)amino]-2-(dimethylamino)benzoyl]amino]propyl-dimethylazanium Traditional Name: 3-[[5-[(4-tert-butylbenzoyl)amino]-2-(dimethylamino)benzoyl]amino]propyl-dimethyl-ammonium Formula: C25H37N4O2+ MolecularWeight: 425.58688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N(C)C)C(=O)NCCC[NH+](C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N(C)C)C(=O)NCCC[NH+](C)C

InChI

InChI=1S/C25H36N4O2/c1-25(2,3)19-11-9-18(10-12-19)23(30)27-20-13-14-22(29(6)7)21(17-20)24(31)26-15-8-16-28(4)5/h9-14,17H,8,15-16H2,1-7H3,(H,26,31)(H,27,30)/p+1