2-diethylaminoethyl 3-iodanyl-2-methyl-2-phenyl-propanoate chloride

Systemtic Name: 2-diethylaminoethyl 3-iodanyl-2-methyl-2-phenyl-propanoate chloride Openeye Name: 2-diethylaminoethyl 3-iodo-2-methyl-2-phenyl-propanoate chloride CAS Name: 3-iodo-2-methyl-2-phenylpropanoic acid 2-diethylaminoethyl ester chloride IUPAC Name: 2-diethylaminoethyl 3-iodo-2-methyl-2-phenylpropanoate chloride Traditional Name: 3-iodo-2-methyl-2-phenyl-propionic acid 2-diethylaminoethyl ester chloride Formula: C16H24ClINO2- MolecularWeight: 424.72473

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C(C)(CI)C1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCN(CC)CCOC(=O)C(C)(CI)C1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C16H24INO2.ClH/c1-4-18(5-2)11-12-20-15(19)16(3,13-17)14-9-7-6-8-10-14;/h6-10H,4-5,11-13H2,1-3H3;1H/p-1