2-(acridin-4-ylcarbonylamino)ethyl-ethyl-[(4-nitrophenyl)methyl]azanium

Systemtic Name: 2-(acridin-4-ylcarbonylamino)ethyl-ethyl-[(4-nitrophenyl)methyl]azanium Openeye Name: 2-(acridine-4-carbonylamino)ethyl-ethyl-[(4-nitrophenyl)methyl]ammonium CAS Name: 2-[[4-acridinyl(oxo)methyl]amino]ethyl-ethyl-[(4-nitrophenyl)methyl]ammonium IUPAC Name: 2-(acridine-4-carbonylamino)ethyl-ethyl-[(4-nitrophenyl)methyl]azanium Traditional Name: 2-(acridine-4-carbonylamino)ethyl-ethyl-(4-nitrobenzyl)ammonium Formula: C25H25N4O3+ MolecularWeight: 429.491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCNC(=O)C1=CC=CC2=CC3=CC=CC=C3N=C21)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC[NH+](CCNC(=O)C1=CC=CC2=CC3=CC=CC=C3N=C21)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H24N4O3/c1-2-28(17-18-10-12-21(13-11-18)29(31)32)15-14-26-25(30)22-8-5-7-20-16-19-6-3-4-9-23(19)27-24(20)22/h3-13,16H,2,14-15,17H2,1H3,(H,26,30)/p+1