ethyl 4-(3-iodanyl-4-methyl-phenyl)carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(3-iodanyl-4-methyl-phenyl)carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(3-iodo-4-methyl-benzoyl)piperazine-1-carboxylate CAS Name: 4-[(3-iodo-4-methylphenyl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-iodo-4-methylbenzoyl)piperazine-1-carboxylate Traditional Name: 4-(3-iodo-4-methyl-benzoyl)piperazine-1-carboxylic acid ethyl ester Formula: C15H19IN2O3 MolecularWeight: 402.22743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)I

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)I

InChI

InChI=1S/C15H19IN2O3/c1-3-21-15(20)18-8-6-17(7-9-18)14(19)12-5-4-11(2)13(16)10-12/h4-5,10H,3,6-9H2,1-2H3