O7-tert-butyl O1-ethyl (2R,6S)-2-azanyl-6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]heptanedioate

Systemtic Name: O7-tert-butyl O1-ethyl (2R,6S)-2-azanyl-6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]heptanedioate Openeye Name: O1-tert-butyl O7-ethyl (2S,6R)-6-amino-2-[bis(tert-butoxycarbonyl)amino]heptanedioate CAS Name: (2R,6S)-2-amino-6-[bis[(2-methylpropan-2-yl)oxy-oxomethyl]amino]heptanedioic acid O7-tert-butyl ester O1-ethyl ester IUPAC Name: 7-O-tert-butyl 1-O-ethyl (2R,6S)-2-amino-6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]heptanedioate Traditional Name: (2S,6R)-6-amino-2-[bis(tert-butoxycarbonyl)amino]pimelic acid O1-tert-butyl ester O7-ethyl ester Formula: C23H42N2O8 MolecularWeight: 474.58818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCC(C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)N

Isomeric SMILES

CCOC(=O)[C@@H](CCC[C@@H](C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)N

InChI

InChI=1S/C23H42N2O8/c1-11-30-17(26)15(24)13-12-14-16(18(27)31-21(2,3)4)25(19(28)32-22(5,6)7)20(29)33-23(8,9)10/h15-16H,11-14,24H2,1-10H3/t15-,16+/m1/s1