2-[(9-azanyl-6-bromanyl-acridin-10-ium-4-yl)carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(9-azanyl-6-bromanyl-acridin-10-ium-4-yl)carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[(9-amino-6-bromo-acridin-10-ium-4-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(9-amino-6-bromo-4-acridin-10-iumyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(9-amino-6-bromoacridin-10-ium-4-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(9-amino-6-bromo-acridin-10-ium-4-carbonyl)amino]ethyl-dimethyl-ammonium Formula: C18H21BrN4O+2 MolecularWeight: 389.28954

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC=CC2=C1[NH+]=C3C=C(C=CC3=C2N)Br

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC=CC2=C1[NH+]=C3C=C(C=CC3=C2N)Br

InChI

InChI=1S/C18H19BrN4O/c1-23(2)9-8-21-18(24)14-5-3-4-13-16(20)12-7-6-11(19)10-15(12)22-17(13)14/h3-7,10H,8-9H2,1-2H3,(H2,20,22)(H,21,24)/p+2