iodanylmethane; 2-piperidin-1-ylethyl 2-(4-chlorophenyl)sulfanyl-2-methyl-propanoate

Systemtic Name: iodanylmethane; 2-piperidin-1-ylethyl 2-(4-chlorophenyl)sulfanyl-2-methyl-propanoate Openeye Name: iodomethane; 2-(1-piperidyl)ethyl 2-(4-chlorophenyl)sulfanyl-2-methyl-propanoate CAS Name: 2-[(4-chlorophenyl)thio]-2-methylpropanoic acid 2-(1-piperidinyl)ethyl ester; iodomethane IUPAC Name: iodomethane; 2-piperidin-1-ylethyl 2-(4-chlorophenyl)sulfanyl-2-methylpropanoate Traditional Name: 2-[(4-chlorophenyl)thio]-2-methyl-propionic acid 2-piperidinoethyl ester; iodomethane Formula: C18H27ClINO2S MolecularWeight: 483.83495

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OCCN1CCCCC1)SC2=CC=C(C=C2)Cl.CI

Isomeric SMILES

CC(C)(C(=O)OCCN1CCCCC1)SC2=CC=C(C=C2)Cl.CI

InChI

InChI=1S/C17H24ClNO2S.CH3I/c1-17(2,22-15-8-6-14(18)7-9-15)16(20)21-13-12-19-10-4-3-5-11-19;1-2/h6-9H,3-5,10-13H2,1-2H3;1H3