ditert-butyl 2-[(2R)-2-benzamido-2-(benzotriazol-1-yl)ethyl]propanedioate

Systemtic Name: ditert-butyl 2-[(2R)-2-benzamido-2-(benzotriazol-1-yl)ethyl]propanedioate Openeye Name: ditert-butyl 2-[(2R)-2-benzamido-2-(benzotriazol-1-yl)ethyl]propanedioate CAS Name: 2-[(2R)-2-benzamido-2-(1-benzotriazolyl)ethyl]propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-[(2R)-2-benzamido-2-(benzotriazol-1-yl)ethyl]propanedioate Traditional Name: 2-[(2R)-2-benzamido-2-(benzotriazol-1-yl)ethyl]malonic acid ditert-butyl ester Formula: C26H32N4O5 MolecularWeight: 480.55608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC(NC(=O)C1=CC=CC=C1)N2C3=CC=CC=C3N=N2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(C[C@H](NC(=O)C1=CC=CC=C1)N2C3=CC=CC=C3N=N2)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H32N4O5/c1-25(2,3)34-23(32)18(24(33)35-26(4,5)6)16-21(27-22(31)17-12-8-7-9-13-17)30-20-15-11-10-14-19(20)28-29-30/h7-15,18,21H,16H2,1-6H3,(H,27,31)/t21-/m1/s1