O1-ethyl O6-[(4-methoxyphenyl)methyl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanedioate

Systemtic Name: O1-ethyl O6-[(4-methoxyphenyl)methyl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanedioate Openeye Name: O1-ethyl O6-[(4-methoxyphenyl)methyl] (2S)-2-(tert-butoxycarbonylamino)hexanedioate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanedioic acid O1-ethyl ester O6-[(4-methoxyphenyl)methyl] ester IUPAC Name: 1-O-ethyl 6-O-[(4-methoxyphenyl)methyl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanedioate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)adipic acid O1-ethyl ester O6-p-anisyl ester Formula: C21H31NO7 MolecularWeight: 409.47334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31NO7/c1-6-27-19(24)17(22-20(25)29-21(2,3)4)8-7-9-18(23)28-14-15-10-12-16(26-5)13-11-15/h10-13,17H,6-9,14H2,1-5H3,(H,22,25)/t17-/m0/s1