3-(2-carboxyethylsulfanyl)-2,2-bis(2,6-diethyl-2,3,6-trimethyl-piperidin-4-yl)propanoic acid

Systemtic Name: 3-(2-carboxyethylsulfanyl)-2,2-bis(2,6-diethyl-2,3,6-trimethyl-piperidin-4-yl)propanoic acid Openeye Name: 3-(2-carboxyethylsulfanyl)-2,2-bis(2,6-diethyl-2,3,6-trimethyl-4-piperidyl)propanoic acid CAS Name: 3-(2-carboxyethylthio)-2,2-bis(2,6-diethyl-2,3,6-trimethyl-4-piperidinyl)propanoic acid IUPAC Name: 3-(2-carboxyethylsulfanyl)-2,2-bis(2,6-diethyl-2,3,6-trimethylpiperidin-4-yl)propanoic acid Traditional Name: 3-(2-carboxyethylthio)-2,2-bis(2,6-diethyl-2,3,6-trimethyl-4-piperidyl)propionic acid Formula: C30H56N2O4S MolecularWeight: 540.84164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(C(C(N1)(C)CC)C)C(CSCCC(=O)O)(C2CC(NC(C2C)(C)CC)(C)CC)C(=O)O)C

Isomeric SMILES

CCC1(CC(C(C(N1)(C)CC)C)C(CSCCC(=O)O)(C2CC(NC(C2C)(C)CC)(C)CC)C(=O)O)C

InChI

InChI=1S/C30H56N2O4S/c1-11-26(7)17-22(20(5)28(9,13-3)31-26)30(25(35)36,19-37-16-15-24(33)34)23-18-27(8,12-2)32-29(10,14-4)21(23)6/h20-23,31-32H,11-19H2,1-10H3,(H,33,34)(H,35,36)