tert-butyl (2S)-2-[[6-chloranyl-5-(2-chloranylethanoylamino)-2-methyl-pyridin-3-yl]oxymethyl]azetidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[[6-chloranyl-5-(2-chloranylethanoylamino)-2-methyl-pyridin-3-yl]oxymethyl]azetidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[[6-chloro-5-[(2-chloroacetyl)amino]-2-methyl-3-pyridyl]oxymethyl]azetidine-1-carboxylate CAS Name: (2S)-2-[[6-chloro-5-[(2-chloro-1-oxoethyl)amino]-2-methyl-3-pyridinyl]oxymethyl]-1-azetidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[6-chloro-5-[(2-chloroacetyl)amino]-2-methylpyridin-3-yl]oxymethyl]azetidine-1-carboxylate Traditional Name: (2S)-2-[[6-chloro-5-[(2-chloroacetyl)amino]-2-methyl-3-pyridyl]oxymethyl]azetidine-1-carboxylic acid tert-butyl ester Formula: C17H23Cl2N3O4 MolecularWeight: 404.28822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)Cl)NC(=O)CCl)OCC2CCN2C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C(=N1)Cl)NC(=O)CCl)OC[C@@H]2CCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C17H23Cl2N3O4/c1-10-13(7-12(15(19)20-10)21-14(23)8-18)25-9-11-5-6-22(11)16(24)26-17(2,3)4/h7,11H,5-6,8-9H2,1-4H3,(H,21,23)/t11-/m0/s1