iodanylmethane; 2-[4-(1-methylpiperidin-4-yl)cyclohexyl]-2-oxidanyl-2-phenyl-ethanoic acid

Systemtic Name: iodanylmethane; 2-[4-(1-methylpiperidin-4-yl)cyclohexyl]-2-oxidanyl-2-phenyl-ethanoic acid Openeye Name: 2-hydroxy-2-[4-(1-methyl-4-piperidyl)cyclohexyl]-2-phenyl-acetic acid; iodomethane CAS Name: 2-hydroxy-2-[4-(1-methyl-4-piperidinyl)cyclohexyl]-2-phenylacetic acid; iodomethane IUPAC Name: 2-hydroxy-2-[4-(1-methylpiperidin-4-yl)cyclohexyl]-2-phenylacetic acid; iodomethane Traditional Name: 2-hydroxy-2-[4-(1-methyl-4-piperidyl)cyclohexyl]-2-phenyl-acetic acid; iodomethane Formula: C21H32INO3 MolecularWeight: 473.38815

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2CCC(CC2)C(C3=CC=CC=C3)(C(=O)O)O.CI

Isomeric SMILES

CN1CCC(CC1)C2CCC(CC2)C(C3=CC=CC=C3)(C(=O)O)O.CI

InChI

InChI=1S/C20H29NO3.CH3I/c1-21-13-11-16(12-14-21)15-7-9-18(10-8-15)20(24,19(22)23)17-5-3-2-4-6-17;1-2/h2-6,15-16,18,24H,7-14H2,1H3,(H,22,23);1H3