tert-butyl 3-[4-[2-[(7-chloranylquinolin-4-yl)amino]ethyl]piperazin-1-yl]carbonylpyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[4-[2-[(7-chloranylquinolin-4-yl)amino]ethyl]piperazin-1-yl]carbonylpyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[4-[2-[(7-chloro-4-quinolyl)amino]ethyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylate CAS Name: 3-[[4-[2-[(7-chloro-4-quinolinyl)amino]ethyl]-1-piperazinyl]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-[2-[(7-chloroquinolin-4-yl)amino]ethyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylate Traditional Name: 3-[4-[2-[(7-chloro-4-quinolyl)amino]ethyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C25H34ClN5O3 MolecularWeight: 488.02216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)C(=O)N2CCN(CC2)CCNC3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)C(=O)N2CCN(CC2)CCNC3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C25H34ClN5O3/c1-25(2,3)34-24(33)31-10-7-18(17-31)23(32)30-14-12-29(13-15-30)11-9-28-21-6-8-27-22-16-19(26)4-5-20(21)22/h4-6,8,16,18H,7,9-15,17H2,1-3H3,(H,27,28)