tert-butyl 1-[2-(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonyloxyethyl]piperidine-4-carboxylate

Systemtic Name: tert-butyl 1-[2-(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonyloxyethyl]piperidine-4-carboxylate Openeye Name: tert-butyl 1-[2-(4-amino-5-chloro-2-methoxy-benzoyl)oxyethyl]piperidine-4-carboxylate CAS Name: 1-[2-[(4-amino-5-chloro-2-methoxyphenyl)-oxomethoxy]ethyl]-4-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2-(4-amino-5-chloro-2-methoxybenzoyl)oxyethyl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-amino-5-chloro-2-methoxy-benzoyl)oxyethyl]isonipecotic acid tert-butyl ester Formula: C20H29ClN2O5 MolecularWeight: 412.90766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCN(CC1)CCOC(=O)C2=CC(=C(C=C2OC)N)Cl

Isomeric SMILES

CC(C)(C)OC(=O)C1CCN(CC1)CCOC(=O)C2=CC(=C(C=C2OC)N)Cl

InChI

InChI=1S/C20H29ClN2O5/c1-20(2,3)28-18(24)13-5-7-23(8-6-13)9-10-27-19(25)14-11-15(21)16(22)12-17(14)26-4/h11-13H,5-10,22H2,1-4H3