tert-butyl (2S)-3-(1H-imidazol-5-yl)-2-[(phenylmethyl)amino]propanoate

Systemtic Name: tert-butyl (2S)-3-(1H-imidazol-5-yl)-2-[(phenylmethyl)amino]propanoate Openeye Name: tert-butyl (2S)-2-(benzylamino)-3-(1H-imidazol-5-yl)propanoate CAS Name: (2S)-3-(1H-imidazol-5-yl)-2-[(phenylmethyl)amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-(benzylamino)-3-(1H-imidazol-5-yl)propanoate Traditional Name: (2S)-2-(benzylamino)-3-(1H-imidazol-5-yl)propionic acid tert-butyl ester Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CN=CN1)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC1=CN=CN1)NCC2=CC=CC=C2

InChI

InChI=1S/C17H23N3O2/c1-17(2,3)22-16(21)15(9-14-11-18-12-20-14)19-10-13-7-5-4-6-8-13/h4-8,11-12,15,19H,9-10H2,1-3H3,(H,18,20)/t15-/m0/s1