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

Systemtic Name: (4-tert-butylphenyl)-[4-[(3-iodanylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[4-[(3-iodophenyl)methyl]-1,4-diazepan-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[4-[(3-iodophenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (4-tert-butylphenyl)-[4-[(3-iodophenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[4-(3-iodobenzyl)-1,4-diazepan-1-yl]methanone Formula: C23H29IN2O MolecularWeight: 476.39363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29IN2O/c1-23(2,3)20-10-8-19(9-11-20)22(27)26-13-5-12-25(14-15-26)17-18-6-4-7-21(24)16-18/h4,6-11,16H,5,12-15,17H2,1-3H3