[4-[(4-iodanylphenyl)methyl]piperazin-1-yl]-quinolin-3-yl-methanone

Systemtic Name: [4-[(4-iodanylphenyl)methyl]piperazin-1-yl]-quinolin-3-yl-methanone Openeye Name: [4-[(4-iodanylphenyl)methyl]piperazin-1-yl]-(3-quinolyl)methanone CAS Name: [4-[(4-iodanylphenyl)methyl]-1-piperazinyl]-(3-quinolinyl)methanone IUPAC Name: [4-[(4-iodanylphenyl)methyl]piperazin-1-yl]-quinolin-3-ylmethanone Traditional Name: [4-(4-iodanylbenzyl)piperazino]-(3-quinolyl)methanone Formula: C21H20IN3O MolecularWeight: 453.308598

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)I)C(=O)C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)[123I])C(=O)C3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C21H20IN3O/c22-19-7-5-16(6-8-19)15-24-9-11-25(12-10-24)21(26)18-13-17-3-1-2-4-20(17)23-14-18/h1-8,13-14H,9-12,15H2/i22-4