methyl 1-[4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl]-1-sulfanidyl-pyrrolidin-1-ium-2-carboxylate

Systemtic Name: methyl 1-[4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl]-1-sulfanidyl-pyrrolidin-1-ium-2-carboxylate Openeye Name: methyl 1-[2-(tert-butoxycarbonylamino)-4-methyl-pentyl]-1-sulfido-pyrrolidin-1-ium-2-carboxylate CAS Name: 1-[4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentyl]-1-sulfido-2-pyrrolidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl]-1-sulfidopyrrolidin-1-ium-2-carboxylate Traditional Name: 1-[2-(tert-butoxycarbonylamino)-4-methyl-pentyl]-1-sulfido-pyrrolidin-1-ium-2-carboxylic acid methyl ester Formula: C17H32N2O4S MolecularWeight: 360.51198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C[N+]1(CCCC1C(=O)OC)[S-])NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CC(C[N+]1(CCCC1C(=O)OC)[S-])NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H32N2O4S/c1-12(2)10-13(18-16(21)23-17(3,4)5)11-19(24)9-7-8-14(19)15(20)22-6/h12-14H,7-11H2,1-6H3,(H,18,21)