tert-butyl 3-[(3-chloranyl-2-methyl-phenyl)carbonyl-cyclopentyl-amino]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(3-chloranyl-2-methyl-phenyl)carbonyl-cyclopentyl-amino]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[(3-chloro-2-methyl-benzoyl)-cyclopentyl-amino]pyrrolidine-1-carboxylate CAS Name: 3-[[(3-chloro-2-methylphenyl)-oxomethyl]-cyclopentylamino]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(3-chloro-2-methylbenzoyl)-cyclopentylamino]pyrrolidine-1-carboxylate Traditional Name: 3-[(3-chloro-2-methyl-benzoyl)-cyclopentyl-amino]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C22H31ClN2O3 MolecularWeight: 406.94614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C(=O)N(C2CCCC2)C3CCN(C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)C(=O)N(C2CCCC2)C3CCN(C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H31ClN2O3/c1-15-18(10-7-11-19(15)23)20(26)25(16-8-5-6-9-16)17-12-13-24(14-17)21(27)28-22(2,3)4/h7,10-11,16-17H,5-6,8-9,12-14H2,1-4H3