(2R)-1-[[1-[(4-tert-butylphenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]butan-2-ol

Systemtic Name: (2R)-1-[[1-[(4-tert-butylphenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]butan-2-ol Openeye Name: (2R)-1-[[1-[(4-tert-butylphenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]butan-2-ol CAS Name: (2R)-1-[[1-[(4-tert-butylphenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-butanol IUPAC Name: (2R)-1-[[1-[(4-tert-butylphenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]butan-2-ol Traditional Name: (2R)-1-[[1-(4-tert-butylbenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]butan-2-ol Formula: C26H40N2O MolecularWeight: 396.6086

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN(CC1=CC=CN1CC2=CC=C(C=C2)C(C)(C)C)C3CCCCC3)O

Isomeric SMILES

CC[C@H](CN(CC1=CC=CN1CC2=CC=C(C=C2)C(C)(C)C)C3CCCCC3)O

InChI

InChI=1S/C26H40N2O/c1-5-25(29)20-28(23-10-7-6-8-11-23)19-24-12-9-17-27(24)18-21-13-15-22(16-14-21)26(2,3)4/h9,12-17,23,25,29H,5-8,10-11,18-20H2,1-4H3/t25-/m1/s1