4-tert-butyl-N-[4-(octylamino)-9,10-bis(oxidanylidene)anthracen-1-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-tert-butyl-N-[4-(octylamino)-9,10-bis(oxidanylidene)anthracen-1-yl]cyclohexane-1-carboxamide Openeye Name: 4-tert-butyl-N-[4-(octylamino)-9,10-dioxo-1-anthryl]cyclohexanecarboxamide CAS Name: 4-tert-butyl-N-[4-(octylamino)-9,10-dioxo-1-anthracenyl]-1-cyclohexanecarboxamide IUPAC Name: 4-tert-butyl-N-[4-(octylamino)-9,10-dioxoanthracen-1-yl]cyclohexane-1-carboxamide Traditional Name: 4-tert-butyl-N-[9,10-diketo-4-(octylamino)-1-anthryl]cyclohexanecarboxamide Formula: C33H44N2O3 MolecularWeight: 516.71406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=C2C(=C(C=C1)NC(=O)C3CCC(CC3)C(C)(C)C)C(=O)C4=CC=CC=C4C2=O

Isomeric SMILES

CCCCCCCCNC1=C2C(=C(C=C1)NC(=O)C3CCC(CC3)C(C)(C)C)C(=O)C4=CC=CC=C4C2=O

InChI

InChI=1S/C33H44N2O3/c1-5-6-7-8-9-12-21-34-26-19-20-27(35-32(38)22-15-17-23(18-16-22)33(2,3)4)29-28(26)30(36)24-13-10-11-14-25(24)31(29)37/h10-11,13-14,19-20,22-23,34H,5-9,12,15-18,21H2,1-4H3,(H,35,38)