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

Systemtic Name: ditert-butyl 4-[3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]-4-(4-oxidanylbutanoylamino)heptanedioate Openeye Name: ditert-butyl 4-(3-tert-butoxy-3-oxo-propyl)-4-(4-hydroxybutanoylamino)heptanedioate CAS Name: 4-[(4-hydroxy-1-oxobutyl)amino]-4-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]heptanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 4-(4-hydroxybutanoylamino)-4-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]heptanedioate Traditional Name: 4-(3-tert-butoxy-3-keto-propyl)-4-(4-hydroxybutanoylamino)pimelic acid ditert-butyl ester Formula: C26H47NO8 MolecularWeight: 501.65328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(CCC(=O)OC(C)(C)C)(CCC(=O)OC(C)(C)C)NC(=O)CCCO

Isomeric SMILES

CC(C)(C)OC(=O)CCC(CCC(=O)OC(C)(C)C)(CCC(=O)OC(C)(C)C)NC(=O)CCCO

InChI

InChI=1S/C26H47NO8/c1-23(2,3)33-20(30)12-15-26(27-19(29)11-10-18-28,16-13-21(31)34-24(4,5)6)17-14-22(32)35-25(7,8)9/h28H,10-18H2,1-9H3,(H,27,29)