iodanylmethane; 4-methyl-1-(4-methylpiperazin-1-yl)-3-phenyl-2-(phenylmethyl)pentan-3-ol

Systemtic Name: iodanylmethane; 4-methyl-1-(4-methylpiperazin-1-yl)-3-phenyl-2-(phenylmethyl)pentan-3-ol Openeye Name: 2-benzyl-4-methyl-1-(4-methylpiperazin-1-yl)-3-phenyl-pentan-3-ol; iodomethane CAS Name: iodomethane; 4-methyl-1-(4-methyl-1-piperazinyl)-3-phenyl-2-(phenylmethyl)-3-pentanol IUPAC Name: 2-benzyl-4-methyl-1-(4-methylpiperazin-1-yl)-3-phenylpentan-3-ol; iodomethane Traditional Name: 2-benzyl-4-methyl-1-(4-methylpiperazino)-3-phenyl-pentan-3-ol; iodomethane Formula: C25H37IN2O MolecularWeight: 508.47855

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CC=C1)(C(CC2=CC=CC=C2)CN3CCN(CC3)C)O.CI

Isomeric SMILES

CC(C)C(C1=CC=CC=C1)(C(CC2=CC=CC=C2)CN3CCN(CC3)C)O.CI

InChI

InChI=1S/C24H34N2O.CH3I/c1-20(2)24(27,22-12-8-5-9-13-22)23(18-21-10-6-4-7-11-21)19-26-16-14-25(3)15-17-26;1-2/h4-13,20,23,27H,14-19H2,1-3H3;1H3