[(2S)-4,10-bis-(4-methylphenyl)sulfonyl-1,7-dioxa-4,10-diazacyclododec-2-yl]methanol

Systemtic Name: [(2S)-4,10-bis-(4-methylphenyl)sulfonyl-1,7-dioxa-4,10-diazacyclododec-2-yl]methanol Openeye Name: [(2S)-4,10-bis(p-tolylsulfonyl)-1,7-dioxa-4,10-diazacyclododec-2-yl]methanol CAS Name: [(2S)-4,10-bis-(4-methylphenyl)sulfonyl-1,7-dioxa-4,10-diazacyclododec-2-yl]methanol IUPAC Name: [(2S)-4,10-bis-(4-methylphenyl)sulfonyl-1,7-dioxa-4,10-diazacyclododec-2-yl]methanol Traditional Name: [(2S)-4,10-ditosyl-1,7-dioxa-4,10-diazacyclododec-2-yl]methanol Formula: C23H32N2O7S2 MolecularWeight: 512.63938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCOCCN(CC(OCC2)CO)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCOCCN(C[C@H](OCC2)CO)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H32N2O7S2/c1-19-3-7-22(8-4-19)33(27,28)24-11-14-31-15-12-25(17-21(18-26)32-16-13-24)34(29,30)23-9-5-20(2)6-10-23/h3-10,21,26H,11-18H2,1-2H3/t21-/m0/s1