[4-[(3-iodanylphenyl)methyl]-1,4-diazepan-1-yl]-(4-methylphenyl)methanone

Systemtic Name: [4-[(3-iodanylphenyl)methyl]-1,4-diazepan-1-yl]-(4-methylphenyl)methanone Openeye Name: [4-[(3-iodophenyl)methyl]-1,4-diazepan-1-yl]-(p-tolyl)methanone CAS Name: [4-[(3-iodophenyl)methyl]-1,4-diazepan-1-yl]-(4-methylphenyl)methanone IUPAC Name: [4-[(3-iodophenyl)methyl]-1,4-diazepan-1-yl]-(4-methylphenyl)methanone Traditional Name: [4-(3-iodobenzyl)-1,4-diazepan-1-yl]-(p-tolyl)methanone Formula: C20H23IN2O MolecularWeight: 434.31389

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC(=CC=C3)I

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC(=CC=C3)I

InChI

InChI=1S/C20H23IN2O/c1-16-6-8-18(9-7-16)20(24)23-11-3-10-22(12-13-23)15-17-4-2-5-19(21)14-17/h2,4-9,14H,3,10-13,15H2,1H3