dimethyl (2S)-2-[(4-azanyl-1-bicyclo[2.2.2]octanyl)carbonylamino]pentanedioate

Systemtic Name: dimethyl (2S)-2-[(4-azanyl-1-bicyclo[2.2.2]octanyl)carbonylamino]pentanedioate Openeye Name: dimethyl (2S)-2-[(4-aminobicyclo[2.2.2]octane-1-carbonyl)amino]pentanedioate CAS Name: (2S)-2-[[(4-amino-1-bicyclo[2.2.2]octanyl)-oxomethyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl (2S)-2-[(4-aminobicyclo[2.2.2]octane-1-carbonyl)amino]pentanedioate Traditional Name: (2S)-2-[(4-aminobicyclo[2.2.2]octane-1-carbonyl)amino]glutaric acid dimethyl ester Formula: C16H26N2O5 MolecularWeight: 326.38804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C(=O)OC)NC(=O)C12CCC(CC1)(CC2)N

Isomeric SMILES

COC(=O)CC[C@@H](C(=O)OC)NC(=O)C12CCC(CC1)(CC2)N

InChI

InChI=1S/C16H26N2O5/c1-22-12(19)4-3-11(13(20)23-2)18-14(21)15-5-8-16(17,9-6-15)10-7-15/h11H,3-10,17H2,1-2H3,(H,18,21)/t11-,15?,16?/m0/s1