N-[9,10-bis(oxidanylidene)-4-(undecylamino)anthracen-1-yl]-4-(4-pentylcyclohexyl)benzamide

Systemtic Name: N-[9,10-bis(oxidanylidene)-4-(undecylamino)anthracen-1-yl]-4-(4-pentylcyclohexyl)benzamide Openeye Name: N-[9,10-dioxo-4-(undecylamino)-1-anthryl]-4-(4-pentylcyclohexyl)benzamide CAS Name: N-[9,10-dioxo-4-(undecylamino)-1-anthracenyl]-4-(4-pentylcyclohexyl)benzamide IUPAC Name: N-[9,10-dioxo-4-(undecylamino)anthracen-1-yl]-4-(4-pentylcyclohexyl)benzamide Traditional Name: 4-(4-amylcyclohexyl)-N-[9,10-diketo-4-(undecylamino)-1-anthryl]benzamide Formula: C43H56N2O3 MolecularWeight: 648.91634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCNC1=C2C(=C(C=C1)NC(=O)C3=CC=C(C=C3)C4CCC(CC4)CCCCC)C(=O)C5=CC=CC=C5C2=O

Isomeric SMILES

CCCCCCCCCCCNC1=C2C(=C(C=C1)NC(=O)C3=CC=C(C=C3)C4CCC(CC4)CCCCC)C(=O)C5=CC=CC=C5C2=O

InChI

InChI=1S/C43H56N2O3/c1-3-5-7-8-9-10-11-12-16-30-44-37-28-29-38(40-39(37)41(46)35-18-14-15-19-36(35)42(40)47)45-43(48)34-26-24-33(25-27-34)32-22-20-31(21-23-32)17-13-6-4-2/h14-15,18-19,24-29,31-32,44H,3-13,16-17,20-23,30H2,1-2H3,(H,45,48)