ditert-butyl (2R)-2-[[4-(prop-2-ynylamino)phenyl]carbonylamino]pentanedioate

Systemtic Name: ditert-butyl (2R)-2-[[4-(prop-2-ynylamino)phenyl]carbonylamino]pentanedioate Openeye Name: ditert-butyl (2R)-2-[[4-(prop-2-ynylamino)benzoyl]amino]pentanedioate CAS Name: (2R)-2-[[oxo-[4-(prop-2-ynylamino)phenyl]methyl]amino]pentanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl (2R)-2-[[4-(prop-2-ynylamino)benzoyl]amino]pentanedioate Traditional Name: (2R)-2-[[4-(propargylamino)benzoyl]amino]glutaric acid ditert-butyl ester Formula: C23H32N2O5 MolecularWeight: 416.51058

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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)NCC#C

Isomeric SMILES

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

InChI

InChI=1S/C23H32N2O5/c1-8-15-24-17-11-9-16(10-12-17)20(27)25-18(21(28)30-23(5,6)7)13-14-19(26)29-22(2,3)4/h1,9-12,18,24H,13-15H2,2-7H3,(H,25,27)/t18-/m1/s1