O4-tert-butyl O1-methyl (2R,3S)-3-(phenylmethoxycarbonylamino)-2-prop-2-ynyl-butanedioate

Systemtic Name: O4-tert-butyl O1-methyl (2R,3S)-3-(phenylmethoxycarbonylamino)-2-prop-2-ynyl-butanedioate Openeye Name: O1-tert-butyl O4-methyl (2S,3R)-2-(benzyloxycarbonylamino)-3-prop-2-ynyl-butanedioate CAS Name: (2R,3S)-3-(phenylmethoxycarbonylamino)-2-prop-2-ynylbutanedioic acid O4-tert-butyl ester O1-methyl ester IUPAC Name: 4-O-tert-butyl 1-O-methyl (2R,3S)-3-(phenylmethoxycarbonylamino)-2-prop-2-ynylbutanedioate Traditional Name: (2S,3R)-2-(benzyloxycarbonylamino)-3-propargyl-succinic acid O1-tert-butyl ester O4-methyl ester Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO6/c1-6-10-15(17(22)25-5)16(18(23)27-20(2,3)4)21-19(24)26-13-14-11-8-7-9-12-14/h1,7-9,11-12,15-16H,10,13H2,2-5H3,(H,21,24)/t15-,16+/m1/s1