2-[[5-[(4-cyanophenyl)carbamoylamino]-2-(dimethylamino)phenyl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[5-[(4-cyanophenyl)carbamoylamino]-2-(dimethylamino)phenyl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[5-[(4-cyanophenyl)carbamoylamino]-2-(dimethylamino)benzoyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[5-[[(4-cyanoanilino)-oxomethyl]amino]-2-(dimethylamino)phenyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[5-[(4-cyanophenyl)carbamoylamino]-2-(dimethylamino)benzoyl]amino]ethyl-diethylazanium Traditional Name: 2-[[5-[(4-cyanophenyl)carbamoylamino]-2-(dimethylamino)benzoyl]amino]ethyl-diethyl-ammonium Formula: C23H31N6O2+ MolecularWeight: 423.53124

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)C#N)N(C)C

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)C#N)N(C)C

InChI

InChI=1S/C23H30N6O2/c1-5-29(6-2)14-13-25-22(30)20-15-19(11-12-21(20)28(3)4)27-23(31)26-18-9-7-17(16-24)8-10-18/h7-12,15H,5-6,13-14H2,1-4H3,(H,25,30)(H2,26,27,31)/p+1