ditert-butyl (2S)-2-[[4-(aminomethyl)phenyl]carbonylamino]pentanedioate

Systemtic Name: ditert-butyl (2S)-2-[[4-(aminomethyl)phenyl]carbonylamino]pentanedioate Openeye Name: ditert-butyl (2S)-2-[[4-(aminomethyl)benzoyl]amino]pentanedioate CAS Name: (2S)-2-[[[4-(aminomethyl)phenyl]-oxomethyl]amino]pentanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (2S)-2-[[4-(aminomethyl)benzoyl]amino]pentanedioate Traditional Name: (2S)-2-[[4-(aminomethyl)benzoyl]amino]glutaric acid ditert-butyl ester Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(C(=O)OC(C)(C)C)NC(=O)C1=CC=C(C=C1)CN

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O5/c1-20(2,3)27-17(24)12-11-16(19(26)28-21(4,5)6)23-18(25)15-9-7-14(13-22)8-10-15/h7-10,16H,11-13,22H2,1-6H3,(H,23,25)/t16-/m0/s1