[4-(2,5-dimethylphenyl)piperazin-1-yl]-(3-iodanyl-4-methyl-phenyl)methanone

Systemtic Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-(3-iodanyl-4-methyl-phenyl)methanone Openeye Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-(3-iodo-4-methyl-phenyl)methanone CAS Name: [4-(2,5-dimethylphenyl)-1-piperazinyl]-(3-iodo-4-methylphenyl)methanone IUPAC Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-(3-iodo-4-methylphenyl)methanone Traditional Name: [4-(2,5-dimethylphenyl)piperazino]-(3-iodo-4-methyl-phenyl)methanone Formula: C20H23IN2O MolecularWeight: 434.31389

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)I

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)I

InChI

InChI=1S/C20H23IN2O/c1-14-4-5-16(3)19(12-14)22-8-10-23(11-9-22)20(24)17-7-6-15(2)18(21)13-17/h4-7,12-13H,8-11H2,1-3H3