ditert-butyl 4-(icosylcarbamoylamino)-4-[3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]heptanedioate

Systemtic Name: ditert-butyl 4-(icosylcarbamoylamino)-4-[3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]heptanedioate Openeye Name: ditert-butyl 4-(3-tert-butoxy-3-oxo-propyl)-4-(icosylcarbamoylamino)heptanedioate CAS Name: 4-[[(eicosylamino)-oxomethyl]amino]-4-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]heptanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 4-(icosylcarbamoylamino)-4-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]heptanedioate Traditional Name: 4-(arachylcarbamoylamino)-4-(3-tert-butoxy-3-keto-propyl)pimelic acid ditert-butyl ester Formula: C43H82N2O7 MolecularWeight: 739.12038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCNC(=O)NC(CCC(=O)OC(C)(C)C)(CCC(=O)OC(C)(C)C)CCC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCNC(=O)NC(CCC(=O)OC(C)(C)C)(CCC(=O)OC(C)(C)C)CCC(=O)OC(C)(C)C

InChI

InChI=1S/C43H82N2O7/c1-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-35-44-39(49)45-43(32-29-36(46)50-40(2,3)4,33-30-37(47)51-41(5,6)7)34-31-38(48)52-42(8,9)10/h11-35H2,1-10H3,(H2,44,45,49)