O7-ethyl O1-methyl (2S)-2-(methoxycarbonylamino)-2-methyl-heptanedioate

Systemtic Name: O7-ethyl O1-methyl (2S)-2-(methoxycarbonylamino)-2-methyl-heptanedioate Openeye Name: O7-ethyl O1-methyl (2S)-2-(methoxycarbonylamino)-2-methyl-heptanedioate CAS Name: (2S)-2-(methoxycarbonylamino)-2-methylheptanedioic acid O7-ethyl ester O1-methyl ester IUPAC Name: 7-O-ethyl 1-O-methyl (2S)-2-(methoxycarbonylamino)-2-methylheptanedioate Traditional Name: (2S)-2-(carbomethoxyamino)-2-methyl-pimelic acid O7-ethyl ester O1-methyl ester Formula: C13H23NO6 MolecularWeight: 289.32482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC(C)(C(=O)OC)NC(=O)OC

Isomeric SMILES

CCOC(=O)CCCC[C@@](C)(C(=O)OC)NC(=O)OC

InChI

InChI=1S/C13H23NO6/c1-5-20-10(15)8-6-7-9-13(2,11(16)18-3)14-12(17)19-4/h5-9H2,1-4H3,(H,14,17)/t13-/m0/s1