tert-butyl N-[(2S)-1-[6-chloranyl-5-(4-ethenylpyridin-2-yl)pyridin-3-yl]oxybutan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[6-chloranyl-5-(4-ethenylpyridin-2-yl)pyridin-3-yl]oxybutan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[[6-chloro-5-(4-vinyl-2-pyridyl)-3-pyridyl]oxymethyl]propyl]carbamate CAS Name: N-[(2S)-1-[[6-chloro-5-(4-ethenyl-2-pyridinyl)-3-pyridinyl]oxy]butan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[6-chloro-5-(4-ethenylpyridin-2-yl)pyridin-3-yl]oxybutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[[6-chloro-5-(4-vinyl-2-pyridyl)-3-pyridyl]oxymethyl]propyl]carbamic acid tert-butyl ester Formula: C21H26ClN3O3 MolecularWeight: 403.90244

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=CN=C(C(=C1)C2=NC=CC(=C2)C=C)Cl)NC(=O)OC(C)(C)C

Isomeric SMILES

CC[C@@H](COC1=CN=C(C(=C1)C2=NC=CC(=C2)C=C)Cl)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H26ClN3O3/c1-6-14-8-9-23-18(10-14)17-11-16(12-24-19(17)22)27-13-15(7-2)25-20(26)28-21(3,4)5/h6,8-12,15H,1,7,13H2,2-5H3,(H,25,26)/t15-/m0/s1