3-[[4-azanyl-3-(dimethylamino)-9,10-bis(oxidanylidene)anthracen-1-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-azanyl-3-(dimethylamino)-9,10-bis(oxidanylidene)anthracen-1-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[4-amino-3-(dimethylamino)-9,10-dioxo-1-anthryl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[4-amino-3-(dimethylamino)-9,10-dioxo-1-anthracenyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[4-amino-3-(dimethylamino)-9,10-dioxoanthracen-1-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[4-amino-3-(dimethylamino)-9,10-diketo-1-anthryl]amino]propyl-dimethyl-ammonium Formula: C21H27N4O2+ MolecularWeight: 367.46468

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=CC(=C(C2=C1C(=O)C3=CC=CC=C3C2=O)N)N(C)C

Isomeric SMILES

C[NH+](C)CCCNC1=CC(=C(C2=C1C(=O)C3=CC=CC=C3C2=O)N)N(C)C

InChI

InChI=1S/C21H26N4O2/c1-24(2)11-7-10-23-15-12-16(25(3)4)19(22)18-17(15)20(26)13-8-5-6-9-14(13)21(18)27/h5-6,8-9,12,23H,7,10-11,22H2,1-4H3/p+1