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

Systemtic Name: 3-[[4-azanyl-3-morpholin-4-yl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[(4-amino-3-morpholino-9,10-dioxo-1-anthryl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[4-amino-3-(4-morpholinyl)-9,10-dioxo-1-anthracenyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(4-amino-3-morpholin-4-yl-9,10-dioxoanthracen-1-yl)amino]propyl-dimethylazanium Traditional Name: 3-[(4-amino-9,10-diketo-3-morpholino-1-anthryl)amino]propyl-dimethyl-ammonium Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=C2C(=C(C(=C1)N3CCOCC3)N)C(=O)C4=CC=CC=C4C2=O

Isomeric SMILES

C[NH+](C)CCCNC1=C2C(=C(C(=C1)N3CCOCC3)N)C(=O)C4=CC=CC=C4C2=O

InChI

InChI=1S/C23H28N4O3/c1-26(2)9-5-8-25-17-14-18(27-10-12-30-13-11-27)21(24)20-19(17)22(28)15-6-3-4-7-16(15)23(20)29/h3-4,6-7,14,25H,5,8-13,24H2,1-2H3/p+1