3-[[9,10-bis(oxidanylidene)-4-(propan-2-ylamino)anthracen-1-yl]amino]propyl-trimethyl-azanium

Systemtic Name: 3-[[9,10-bis(oxidanylidene)-4-(propan-2-ylamino)anthracen-1-yl]amino]propyl-trimethyl-azanium Openeye Name: 3-[[4-(isopropylamino)-9,10-dioxo-1-anthryl]amino]propyl-trimethyl-ammonium CAS Name: 3-[[9,10-dioxo-4-(propan-2-ylamino)-1-anthracenyl]amino]propyl-trimethylammonium IUPAC Name: 3-[[9,10-dioxo-4-(propan-2-ylamino)anthracen-1-yl]amino]propyl-trimethylazanium Traditional Name: 3-[[4-(isopropylamino)-9,10-diketo-1-anthryl]amino]propyl-trimethyl-ammonium Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C2C(=C(C=C1)NCCC[N+](C)(C)C)C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)NC1=C2C(=C(C=C1)NCCC[N+](C)(C)C)C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C23H29N3O2/c1-15(2)25-19-12-11-18(24-13-8-14-26(3,4)5)20-21(19)23(28)17-10-7-6-9-16(17)22(20)27/h6-7,9-12,15H,8,13-14H2,1-5H3,(H-,24,25,27,28)/p+1