tert-butyl 4-(6-chloranyl-5-ethenoxy-pyridin-3-yl)-1,4-diazepane-1-carboxylate

Systemtic Name: tert-butyl 4-(6-chloranyl-5-ethenoxy-pyridin-3-yl)-1,4-diazepane-1-carboxylate Openeye Name: tert-butyl 4-(6-chloro-5-vinyloxy-3-pyridyl)-1,4-diazepane-1-carboxylate CAS Name: 4-(6-chloro-5-ethenoxy-3-pyridinyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-chloro-5-ethenoxypyridin-3-yl)-1,4-diazepane-1-carboxylate Traditional Name: 4-(6-chloro-5-vinyloxy-3-pyridyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester Formula: C17H24ClN3O3 MolecularWeight: 353.84376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCN(CC1)C2=CC(=C(N=C2)Cl)OC=C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCN(CC1)C2=CC(=C(N=C2)Cl)OC=C

InChI

InChI=1S/C17H24ClN3O3/c1-5-23-14-11-13(12-19-15(14)18)20-7-6-8-21(10-9-20)16(22)24-17(2,3)4/h5,11-12H,1,6-10H2,2-4H3