tert-butyl 4-[2-[2-(4-azanyl-3-chloranyl-phenoxy)-6-cyano-quinolin-7-yl]oxyethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[2-(4-azanyl-3-chloranyl-phenoxy)-6-cyano-quinolin-7-yl]oxyethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[[2-(4-amino-3-chloro-phenoxy)-6-cyano-7-quinolyl]oxy]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[[2-(4-amino-3-chlorophenoxy)-6-cyano-7-quinolinyl]oxy]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[2-(4-amino-3-chlorophenoxy)-6-cyanoquinolin-7-yl]oxyethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[[2-(4-amino-3-chloro-phenoxy)-6-cyano-7-quinolyl]oxy]ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H31ClN4O4 MolecularWeight: 523.02314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCOC2=CC3=C(C=CC(=N3)OC4=CC(=C(C=C4)N)Cl)C=C2C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCOC2=CC3=C(C=CC(=N3)OC4=CC(=C(C=C4)N)Cl)C=C2C#N

InChI

InChI=1S/C28H31ClN4O4/c1-28(2,3)37-27(34)33-11-8-18(9-12-33)10-13-35-25-16-24-19(14-20(25)17-30)4-7-26(32-24)36-21-5-6-23(31)22(29)15-21/h4-7,14-16,18H,8-13,31H2,1-3H3