O5-tert-butyl O1-methyl (4S)-4-(phenylmethoxycarbonylamino)-2-prop-2-enyl-pentanedioate

Systemtic Name: O5-tert-butyl O1-methyl (4S)-4-(phenylmethoxycarbonylamino)-2-prop-2-enyl-pentanedioate Openeye Name: O1-tert-butyl O5-methyl (2S)-4-allyl-2-(benzyloxycarbonylamino)pentanedioate CAS Name: (4S)-4-(phenylmethoxycarbonylamino)-2-prop-2-enylpentanedioic acid O5-tert-butyl ester O1-methyl ester IUPAC Name: 5-O-tert-butyl 1-O-methyl (4S)-4-(phenylmethoxycarbonylamino)-2-prop-2-enylpentanedioate Traditional Name: (2S)-4-allyl-2-(benzyloxycarbonylamino)glutaric acid O1-tert-butyl ester O5-methyl ester Formula: C21H29NO6 MolecularWeight: 391.45806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO6/c1-6-10-16(18(23)26-5)13-17(19(24)28-21(2,3)4)22-20(25)27-14-15-11-8-7-9-12-15/h6-9,11-12,16-17H,1,10,13-14H2,2-5H3,(H,22,25)/t16?,17-/m0/s1