[4-[[4-[(7-chloranylquinolin-4-yl)amino]phenyl]methylamino]piperidin-1-yl]-phenyl-methanone

Systemtic Name: [4-[[4-[(7-chloranylquinolin-4-yl)amino]phenyl]methylamino]piperidin-1-yl]-phenyl-methanone Openeye Name: [4-[[4-[(7-chloro-4-quinolyl)amino]phenyl]methylamino]-1-piperidyl]-phenyl-methanone CAS Name: [4-[[4-[(7-chloro-4-quinolinyl)amino]phenyl]methylamino]-1-piperidinyl]-phenylmethanone IUPAC Name: [4-[[4-[(7-chloroquinolin-4-yl)amino]phenyl]methylamino]piperidin-1-yl]-phenylmethanone Traditional Name: [4-[[4-[(7-chloro-4-quinolyl)amino]benzyl]amino]piperidino]-phenyl-methanone Formula: C28H27ClN4O MolecularWeight: 470.99318

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCC2=CC=C(C=C2)NC3=C4C=CC(=CC4=NC=C3)Cl)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NCC2=CC=C(C=C2)NC3=C4C=CC(=CC4=NC=C3)Cl)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H27ClN4O/c29-22-8-11-25-26(12-15-30-27(25)18-22)32-24-9-6-20(7-10-24)19-31-23-13-16-33(17-14-23)28(34)21-4-2-1-3-5-21/h1-12,15,18,23,31H,13-14,16-17,19H2,(H,30,32)