2-[(9-azanyl-5-methyl-acridin-4-yl)carbonylamino]ethyl-bis(2-methoxyethyl)-[(4-nitrophenyl)methyl]azanium

Systemtic Name: 2-[(9-azanyl-5-methyl-acridin-4-yl)carbonylamino]ethyl-bis(2-methoxyethyl)-[(4-nitrophenyl)methyl]azanium Openeye Name: 2-[(9-amino-5-methyl-acridine-4-carbonyl)amino]ethyl-bis(2-methoxyethyl)-[(4-nitrophenyl)methyl]ammonium CAS Name: 2-[[(9-amino-5-methyl-4-acridinyl)-oxomethyl]amino]ethyl-bis(2-methoxyethyl)-[(4-nitrophenyl)methyl]ammonium IUPAC Name: 2-[(9-amino-5-methylacridine-4-carbonyl)amino]ethyl-bis(2-methoxyethyl)-[(4-nitrophenyl)methyl]azanium Traditional Name: 2-[(9-amino-5-methyl-acridine-4-carbonyl)amino]ethyl-bis(2-methoxyethyl)-(4-nitrobenzyl)ammonium Formula: C30H36N5O5+ MolecularWeight: 546.63734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C(C3=C(C(=CC=C3)C(=O)NCC[N+](CCOC)(CCOC)CC4=CC=C(C=C4)[N+](=O)[O-])N=C12)N

Isomeric SMILES

CC1=CC=CC2=C(C3=C(C(=CC=C3)C(=O)NCC[N+](CCOC)(CCOC)CC4=CC=C(C=C4)[N+](=O)[O-])N=C12)N

InChI

InChI=1S/C30H35N5O5/c1-21-6-4-7-24-27(31)25-8-5-9-26(29(25)33-28(21)24)30(36)32-14-15-35(16-18-39-2,17-19-40-3)20-22-10-12-23(13-11-22)34(37)38/h4-13H,14-20H2,1-3H3,(H2-,31,32,33,36)/p+1