1-[(3-methylphenyl)methyl]-2-[(4-methylpiperazin-1-yl)methyl]cyclododecan-1-ol

Systemtic Name: 1-[(3-methylphenyl)methyl]-2-[(4-methylpiperazin-1-yl)methyl]cyclododecan-1-ol Openeye Name: 2-[(4-methylpiperazin-1-yl)methyl]-1-(m-tolylmethyl)cyclododecanol CAS Name: 1-[(3-methylphenyl)methyl]-2-[(4-methyl-1-piperazinyl)methyl]-1-cyclododecanol IUPAC Name: 1-[(3-methylphenyl)methyl]-2-[(4-methylpiperazin-1-yl)methyl]cyclododecan-1-ol Traditional Name: 1-(3-methylbenzyl)-2-[(4-methylpiperazino)methyl]cyclododecanol Formula: C26H44N2O MolecularWeight: 400.64036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2(CCCCCCCCCCC2CN3CCN(CC3)C)O

Isomeric SMILES

CC1=CC(=CC=C1)CC2(CCCCCCCCCCC2CN3CCN(CC3)C)O

InChI

InChI=1S/C26H44N2O/c1-23-12-11-13-24(20-23)21-26(29)15-10-8-6-4-3-5-7-9-14-25(26)22-28-18-16-27(2)17-19-28/h11-13,20,25,29H,3-10,14-19,21-22H2,1-2H3