4-[(2-chloranylquinolin-3-yl)methyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[(2-chloranylquinolin-3-yl)methyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[(2-chloro-3-quinolyl)methyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[(2-chloro-3-quinolinyl)methyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[(2-chloroquinolin-3-yl)methyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[(2-chloro-3-quinolyl)methyl]-N-phenyl-piperazine-1-carboxamide Formula: C21H21ClN4O MolecularWeight: 380.87064

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=CC=CC=C3N=C2Cl)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC3=CC=CC=C3N=C2Cl)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H21ClN4O/c22-20-17(14-16-6-4-5-9-19(16)24-20)15-25-10-12-26(13-11-25)21(27)23-18-7-2-1-3-8-18/h1-9,14H,10-13,15H2,(H,23,27)