ditert-butyl (2S)-2-[[4-(hydroxymethyl)phenyl]carbamoylamino]pentanedioate

Systemtic Name: ditert-butyl (2S)-2-[[4-(hydroxymethyl)phenyl]carbamoylamino]pentanedioate Openeye Name: ditert-butyl (2S)-2-[[4-(hydroxymethyl)phenyl]carbamoylamino]pentanedioate CAS Name: (2S)-2-[[[4-(hydroxymethyl)anilino]-oxomethyl]amino]pentanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (2S)-2-[[4-(hydroxymethyl)phenyl]carbamoylamino]pentanedioate Traditional Name: (2S)-2-[(4-methylolphenyl)carbamoylamino]glutaric acid ditert-butyl ester Formula: C21H32N2O6 MolecularWeight: 408.48858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(C(=O)OC(C)(C)C)NC(=O)NC1=CC=C(C=C1)CO

Isomeric SMILES

CC(C)(C)OC(=O)CC[C@@H](C(=O)OC(C)(C)C)NC(=O)NC1=CC=C(C=C1)CO

InChI

InChI=1S/C21H32N2O6/c1-20(2,3)28-17(25)12-11-16(18(26)29-21(4,5)6)23-19(27)22-15-9-7-14(13-24)8-10-15/h7-10,16,24H,11-13H2,1-6H3,(H2,22,23,27)/t16-/m0/s1