tert-butyl 3-[6-chloranyl-5-(3-methoxyphenyl)pyridin-3-yl]oxypyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[6-chloranyl-5-(3-methoxyphenyl)pyridin-3-yl]oxypyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[[6-chloro-5-(3-methoxyphenyl)-3-pyridyl]oxy]pyrrolidine-1-carboxylate CAS Name: 3-[[6-chloro-5-(3-methoxyphenyl)-3-pyridinyl]oxy]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[6-chloro-5-(3-methoxyphenyl)pyridin-3-yl]oxypyrrolidine-1-carboxylate Traditional Name: 3-[[6-chloro-5-(3-methoxyphenyl)-3-pyridyl]oxy]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H25ClN2O4 MolecularWeight: 404.8872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)OC2=CN=C(C(=C2)C3=CC(=CC=C3)OC)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)OC2=CN=C(C(=C2)C3=CC(=CC=C3)OC)Cl

InChI

InChI=1S/C21H25ClN2O4/c1-21(2,3)28-20(25)24-9-8-16(13-24)27-17-11-18(19(22)23-12-17)14-6-5-7-15(10-14)26-4/h5-7,10-12,16H,8-9,13H2,1-4H3