tert-butyl (E,2S)-6-azanyl-6-oxidanylidene-2-(phenylmethoxycarbonylamino)hex-4-enoate

Systemtic Name: tert-butyl (E,2S)-6-azanyl-6-oxidanylidene-2-(phenylmethoxycarbonylamino)hex-4-enoate Openeye Name: tert-butyl (E,2S)-6-amino-2-(benzyloxycarbonylamino)-6-oxo-hex-4-enoate CAS Name: (E,2S)-6-amino-6-oxo-2-(phenylmethoxycarbonylamino)-4-hexenoic acid tert-butyl ester IUPAC Name: tert-butyl (E,2S)-6-amino-6-oxo-2-(phenylmethoxycarbonylamino)hex-4-enoate Traditional Name: (E,2S)-6-amino-2-(benzyloxycarbonylamino)-6-keto-hex-4-enoic acid tert-butyl ester Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC=CC(=O)N)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](C/C=C/C(=O)N)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C18H24N2O5/c1-18(2,3)25-16(22)14(10-7-11-15(19)21)20-17(23)24-12-13-8-5-4-6-9-13/h4-9,11,14H,10,12H2,1-3H3,(H2,19,21)(H,20,23)/b11-7+/t14-/m0/s1