ditert-butyl (2S)-2-[[4-(3-prop-2-enoxypropanoylamino)phenyl]carbonylamino]pentanedioate

Systemtic Name: ditert-butyl (2S)-2-[[4-(3-prop-2-enoxypropanoylamino)phenyl]carbonylamino]pentanedioate Openeye Name: ditert-butyl (2S)-2-[[4-(3-allyloxypropanoylamino)benzoyl]amino]pentanedioate CAS Name: (2S)-2-[[oxo-[4-[(1-oxo-3-prop-2-enoxypropyl)amino]phenyl]methyl]amino]pentanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (2S)-2-[[4-(3-prop-2-enoxypropanoylamino)benzoyl]amino]pentanedioate Traditional Name: (2S)-2-[[4-(3-allyloxypropanoylamino)benzoyl]amino]glutaric acid ditert-butyl ester Formula: C26H38N2O7 MolecularWeight: 490.58912

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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)NC(=O)CCOCC=C

Isomeric SMILES

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

InChI

InChI=1S/C26H38N2O7/c1-8-16-33-17-15-21(29)27-19-11-9-18(10-12-19)23(31)28-20(24(32)35-26(5,6)7)13-14-22(30)34-25(2,3)4/h8-12,20H,1,13-17H2,2-7H3,(H,27,29)(H,28,31)/t20-/m0/s1