4-bromanyl-2-[[3-[(7-chloranylquinolin-4-yl)amino]propyl-(phenylmethyl)amino]methyl]phenol

Systemtic Name: 4-bromanyl-2-[[3-[(7-chloranylquinolin-4-yl)amino]propyl-(phenylmethyl)amino]methyl]phenol Openeye Name: 2-[[benzyl-[3-[(7-chloro-4-quinolyl)amino]propyl]amino]methyl]-4-bromo-phenol CAS Name: 4-bromo-2-[[3-[(7-chloro-4-quinolinyl)amino]propyl-(phenylmethyl)amino]methyl]phenol IUPAC Name: 2-[[benzyl-[3-[(7-chloroquinolin-4-yl)amino]propyl]amino]methyl]-4-bromophenol Traditional Name: 2-[[benzyl-[3-[(7-chloro-4-quinolyl)amino]propyl]amino]methyl]-4-bromo-phenol Formula: C26H25BrClN3O MolecularWeight: 510.8532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCNC2=C3C=CC(=CC3=NC=C2)Cl)CC4=C(C=CC(=C4)Br)O

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCNC2=C3C=CC(=CC3=NC=C2)Cl)CC4=C(C=CC(=C4)Br)O

InChI

InChI=1S/C26H25BrClN3O/c27-21-7-10-26(32)20(15-21)18-31(17-19-5-2-1-3-6-19)14-4-12-29-24-11-13-30-25-16-22(28)8-9-23(24)25/h1-3,5-11,13,15-16,32H,4,12,14,17-18H2,(H,29,30)