ditert-butyl (2S)-2-[[4-[[2-[bis(2-hydroxyethyl)amino]phenyl]carbamoyloxymethyl]phenoxy]carbonylamino]pentanedioate

Systemtic Name: ditert-butyl (2S)-2-[[4-[[2-[bis(2-hydroxyethyl)amino]phenyl]carbamoyloxymethyl]phenoxy]carbonylamino]pentanedioate Openeye Name: ditert-butyl (2S)-2-[[4-[[2-[bis(2-hydroxyethyl)amino]phenyl]carbamoyloxymethyl]phenoxy]carbonylamino]pentanedioate CAS Name: (2S)-2-[[[4-[[[2-[bis(2-hydroxyethyl)amino]anilino]-oxomethoxy]methyl]phenoxy]-oxomethyl]amino]pentanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (2S)-2-[[4-[[2-[bis(2-hydroxyethyl)amino]phenyl]carbamoyloxymethyl]phenoxy]carbonylamino]pentanedioate Traditional Name: (2S)-2-[[4-[[2-[bis(2-hydroxyethyl)amino]phenyl]carbamoyloxymethyl]phenoxy]carbonylamino]glutaric acid ditert-butyl ester Formula: C32H45N3O10 MolecularWeight: 631.7138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(C(=O)OC(C)(C)C)NC(=O)OC1=CC=C(C=C1)COC(=O)NC2=CC=CC=C2N(CCO)CCO

Isomeric SMILES

CC(C)(C)OC(=O)CC[C@@H](C(=O)OC(C)(C)C)NC(=O)OC1=CC=C(C=C1)COC(=O)NC2=CC=CC=C2N(CCO)CCO

InChI

InChI=1S/C32H45N3O10/c1-31(2,3)44-27(38)16-15-25(28(39)45-32(4,5)6)34-30(41)43-23-13-11-22(12-14-23)21-42-29(40)33-24-9-7-8-10-26(24)35(17-19-36)18-20-37/h7-14,25,36-37H,15-21H2,1-6H3,(H,33,40)(H,34,41)/t25-/m0/s1