4-(7-chloranylquinolin-4-yl)-N-[3-[(4-fluorophenyl)methoxy]cycloheptyl]piperazine-1-carboxamide

Systemtic Name: 4-(7-chloranylquinolin-4-yl)-N-[3-[(4-fluorophenyl)methoxy]cycloheptyl]piperazine-1-carboxamide Openeye Name: 4-(7-chloro-4-quinolyl)-N-[3-[(4-fluorophenyl)methoxy]cycloheptyl]piperazine-1-carboxamide CAS Name: 4-(7-chloro-4-quinolinyl)-N-[3-[(4-fluorophenyl)methoxy]cycloheptyl]-1-piperazinecarboxamide IUPAC Name: 4-(7-chloroquinolin-4-yl)-N-[3-[(4-fluorophenyl)methoxy]cycloheptyl]piperazine-1-carboxamide Traditional Name: 4-(7-chloro-4-quinolyl)-N-[3-(4-fluorobenzyl)oxycycloheptyl]piperazine-1-carboxamide Formula: C28H32ClFN4O2 MolecularWeight: 511.030683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC(C1)NC(=O)N2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl)OCC5=CC=C(C=C5)F

Isomeric SMILES

C1CCC(CC(C1)NC(=O)N2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl)OCC5=CC=C(C=C5)F

InChI

InChI=1S/C28H32ClFN4O2/c29-21-7-10-25-26(17-21)31-12-11-27(25)33-13-15-34(16-14-33)28(35)32-23-3-1-2-4-24(18-23)36-19-20-5-8-22(30)9-6-20/h5-12,17,23-24H,1-4,13-16,18-19H2,(H,32,35)