(2R)-2-methyl-1,4-bis-(4-methylphenyl)sulfonyl-1,4-diazepan-6-ol

Systemtic Name: (2R)-2-methyl-1,4-bis-(4-methylphenyl)sulfonyl-1,4-diazepan-6-ol Openeye Name: (2R)-2-methyl-1,4-bis(p-tolylsulfonyl)-1,4-diazepan-6-ol CAS Name: (2R)-2-methyl-1,4-bis-(4-methylphenyl)sulfonyl-1,4-diazepan-6-ol IUPAC Name: (2R)-2-methyl-1,4-bis-(4-methylphenyl)sulfonyl-1,4-diazepan-6-ol Traditional Name: (2R)-2-methyl-1,4-ditosyl-1,4-diazepan-6-ol Formula: C20H26N2O5S2 MolecularWeight: 438.56084

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(CN1S(=O)(=O)C2=CC=C(C=C2)C)O)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

C[C@@H]1CN(CC(CN1S(=O)(=O)C2=CC=C(C=C2)C)O)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H26N2O5S2/c1-15-4-8-19(9-5-15)28(24,25)21-12-17(3)22(14-18(23)13-21)29(26,27)20-10-6-16(2)7-11-20/h4-11,17-18,23H,12-14H2,1-3H3/t17-,18?/m1/s1