3-cyclopentyl-1-[5-(dimethylamino)-2-[[4-(dimethylamino)-2-iodanyl-phenyl]methyl]phenyl]prop-2-yn-1-one

Systemtic Name: 3-cyclopentyl-1-[5-(dimethylamino)-2-[[4-(dimethylamino)-2-iodanyl-phenyl]methyl]phenyl]prop-2-yn-1-one Openeye Name: 3-cyclopentyl-1-[5-(dimethylamino)-2-[[4-(dimethylamino)-2-iodo-phenyl]methyl]phenyl]prop-2-yn-1-one CAS Name: 3-cyclopentyl-1-[5-(dimethylamino)-2-[[4-(dimethylamino)-2-iodophenyl]methyl]phenyl]-2-propyn-1-one IUPAC Name: 3-cyclopentyl-1-[5-(dimethylamino)-2-[[4-(dimethylamino)-2-iodophenyl]methyl]phenyl]prop-2-yn-1-one Traditional Name: 3-cyclopentyl-1-[5-(dimethylamino)-2-[4-(dimethylamino)-2-iodo-benzyl]phenyl]prop-2-yn-1-one Formula: C25H24IN2O MolecularWeight: 495.37533

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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#C[C]3[CH][CH][CH][CH]3

Isomeric SMILES

CN(C)C1=CC(=C(C=C1)CC2=C(C=C(C=C2)N(C)C)I)C(=O)C#C[C]3[CH][CH][CH][CH]3

InChI

InChI=1S/C25H24IN2O/c1-27(2)21-12-10-19(15-20-11-13-22(28(3)4)17-24(20)26)23(16-21)25(29)14-9-18-7-5-6-8-18/h5-8,10-13,16-17H,15H2,1-4H3