[4,5-bis(heptanoylamino)-8-heptanoyloxy-9,10-bis(oxidanylidene)anthracen-1-yl] heptanoate

Systemtic Name: [4,5-bis(heptanoylamino)-8-heptanoyloxy-9,10-bis(oxidanylidene)anthracen-1-yl] heptanoate Openeye Name: [4,5-bis(heptanoylamino)-8-heptanoyloxy-9,10-dioxo-1-anthryl] heptanoate CAS Name: heptanoic acid [9,10-dioxo-8-(1-oxoheptoxy)-4,5-bis(1-oxoheptylamino)-1-anthracenyl] ester IUPAC Name: [4,5-bis(heptanoylamino)-8-heptanoyloxy-9,10-dioxoanthracen-1-yl] heptanoate Traditional Name: enanthic acid [4,5-bis(enanthylamino)-8-enanthyloxy-9,10-diketo-1-anthryl] ester Formula: C42H58N2O8 MolecularWeight: 718.91852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1=C2C(=C(C=C1)OC(=O)CCCCCC)C(=O)C3=C(C=CC(=C3C2=O)NC(=O)CCCCCC)OC(=O)CCCCCC

Isomeric SMILES

CCCCCCC(=O)NC1=C2C(=C(C=C1)OC(=O)CCCCCC)C(=O)C3=C(C=CC(=C3C2=O)NC(=O)CCCCCC)OC(=O)CCCCCC

InChI

InChI=1S/C42H58N2O8/c1-5-9-13-17-21-33(45)43-29-25-27-31(51-35(47)23-19-15-11-7-3)39-37(29)41(49)38-30(44-34(46)22-18-14-10-6-2)26-28-32(40(38)42(39)50)52-36(48)24-20-16-12-8-4/h25-28H,5-24H2,1-4H3,(H,43,45)(H,44,46)