O6-tert-butyl O1-methyl (2S,3R)-2-(methoxycarbonylamino)-3-(4-methoxyphenyl)hexanedioate

Systemtic Name: O6-tert-butyl O1-methyl (2S,3R)-2-(methoxycarbonylamino)-3-(4-methoxyphenyl)hexanedioate Openeye Name: O6-tert-butyl O1-methyl (2S,3R)-2-(methoxycarbonylamino)-3-(4-methoxyphenyl)hexanedioate CAS Name: (2S,3R)-2-(methoxycarbonylamino)-3-(4-methoxyphenyl)hexanedioic acid O6-tert-butyl ester O1-methyl ester IUPAC Name: 6-O-tert-butyl 1-O-methyl (2S,3R)-2-(methoxycarbonylamino)-3-(4-methoxyphenyl)hexanedioate Traditional Name: (2S,3R)-2-(carbomethoxyamino)-3-(4-methoxyphenyl)adipic acid O6-tert-butyl ester O1-methyl ester Formula: C20H29NO7 MolecularWeight: 395.44676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29NO7/c1-20(2,3)28-16(22)12-11-15(13-7-9-14(25-4)10-8-13)17(18(23)26-5)21-19(24)27-6/h7-10,15,17H,11-12H2,1-6H3,(H,21,24)/t15-,17+/m1/s1