1-[5-(dimethylamino)-2-[[4-(dimethylamino)-2-iodanyl-phenyl]methyl]phenyl]-4-methoxy-but-2-yn-1-one

Systemtic Name: 1-[5-(dimethylamino)-2-[[4-(dimethylamino)-2-iodanyl-phenyl]methyl]phenyl]-4-methoxy-but-2-yn-1-one Openeye Name: 1-[5-(dimethylamino)-2-[[4-(dimethylamino)-2-iodo-phenyl]methyl]phenyl]-4-methoxy-but-2-yn-1-one CAS Name: 1-[5-(dimethylamino)-2-[[4-(dimethylamino)-2-iodophenyl]methyl]phenyl]-4-methoxy-2-butyn-1-one IUPAC Name: 1-[5-(dimethylamino)-2-[[4-(dimethylamino)-2-iodophenyl]methyl]phenyl]-4-methoxybut-2-yn-1-one Traditional Name: 1-[5-(dimethylamino)-2-[4-(dimethylamino)-2-iodo-benzyl]phenyl]-4-methoxy-but-2-yn-1-one Formula: C22H25IN2O2 MolecularWeight: 476.35057

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=C(C=C1)CC2=C(C=C(C=C2)N(C)C)I)C(=O)C#CCOC

Isomeric SMILES

CN(C)C1=CC(=C(C=C1)CC2=C(C=C(C=C2)N(C)C)I)C(=O)C#CCOC

InChI

InChI=1S/C22H25IN2O2/c1-24(2)18-10-8-16(20(14-18)22(26)7-6-12-27-5)13-17-9-11-19(25(3)4)15-21(17)23/h8-11,14-15H,12-13H2,1-5H3