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

Systemtic Name: 3-[[4-(cyclohexylamino)-9,10-bis(oxidanylidene)anthracen-1-yl]amino]propyl-trimethyl-azanium Openeye Name: 3-[[4-(cyclohexylamino)-9,10-dioxo-1-anthryl]amino]propyl-trimethyl-ammonium CAS Name: 3-[[4-(cyclohexylamino)-9,10-dioxo-1-anthracenyl]amino]propyl-trimethylammonium IUPAC Name: 3-[[4-(cyclohexylamino)-9,10-dioxoanthracen-1-yl]amino]propyl-trimethylazanium Traditional Name: 3-[[4-(cyclohexylamino)-9,10-diketo-1-anthryl]amino]propyl-trimethyl-ammonium Formula: C26H34N3O2+ MolecularWeight: 420.56706

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCNC1=C2C(=C(C=C1)NC3CCCCC3)C(=O)C4=CC=CC=C4C2=O

Isomeric SMILES

C[N+](C)(C)CCCNC1=C2C(=C(C=C1)NC3CCCCC3)C(=O)C4=CC=CC=C4C2=O

InChI

InChI=1S/C26H33N3O2/c1-29(2,3)17-9-16-27-21-14-15-22(28-18-10-5-4-6-11-18)24-23(21)25(30)19-12-7-8-13-20(19)26(24)31/h7-8,12-15,18H,4-6,9-11,16-17H2,1-3H3,(H-,27,28,30,31)/p+1