2-[2-[[(3-iodanylphenyl)methylamino]methyl]pentylamino]-1H-quinolin-4-one

Systemtic Name: 2-[2-[[(3-iodanylphenyl)methylamino]methyl]pentylamino]-1H-quinolin-4-one Openeye Name: 2-[2-[[(3-iodophenyl)methylamino]methyl]pentylamino]-1H-quinolin-4-one CAS Name: 2-[2-[[(3-iodophenyl)methylamino]methyl]pentylamino]-1H-quinolin-4-one IUPAC Name: 2-[2-[[(3-iodophenyl)methylamino]methyl]pentylamino]-1H-quinolin-4-one Traditional Name: 2-[2-[[(3-iodobenzyl)amino]methyl]pentylamino]-4-quinolone Formula: C22H26IN3O MolecularWeight: 475.36581

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CNCC1=CC(=CC=C1)I)CNC2=CC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCC(CNCC1=CC(=CC=C1)I)CNC2=CC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C22H26IN3O/c1-2-6-17(14-24-13-16-7-5-8-18(23)11-16)15-25-22-12-21(27)19-9-3-4-10-20(19)26-22/h3-5,7-12,17,24H,2,6,13-15H2,1H3,(H2,25,26,27)