tert-butyl 2-[[5-(3-aminophenyl)-6-chloranyl-pyridin-3-yl]oxymethyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[5-(3-aminophenyl)-6-chloranyl-pyridin-3-yl]oxymethyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[[5-(3-aminophenyl)-6-chloro-3-pyridyl]oxymethyl]pyrrolidine-1-carboxylate CAS Name: 2-[[5-(3-aminophenyl)-6-chloro-3-pyridinyl]oxymethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[5-(3-aminophenyl)-6-chloropyridin-3-yl]oxymethyl]pyrrolidine-1-carboxylate Traditional Name: 2-[[5-(3-aminophenyl)-6-chloro-3-pyridyl]oxymethyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H26ClN3O3 MolecularWeight: 403.90244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1COC2=CN=C(C(=C2)C3=CC(=CC=C3)N)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1COC2=CN=C(C(=C2)C3=CC(=CC=C3)N)Cl

InChI

InChI=1S/C21H26ClN3O3/c1-21(2,3)28-20(26)25-9-5-8-16(25)13-27-17-11-18(19(22)24-12-17)14-6-4-7-15(23)10-14/h4,6-7,10-12,16H,5,8-9,13,23H2,1-3H3