2-[[(1R)-1-(furan-2-yl)butyl]-(4-methylphenyl)sulfonyl-amino]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[[(1R)-1-(furan-2-yl)butyl]-(4-methylphenyl)sulfonyl-amino]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[[(1R)-1-(2-furyl)butyl]-(p-tolylsulfonyl)amino]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[[(1R)-1-(2-furanyl)butyl]-(4-methylphenyl)sulfonylamino]ethyl ester IUPAC Name: 2-[[(1R)-1-(furan-2-yl)butyl]-(4-methylphenyl)sulfonylamino]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[[(1R)-1-(2-furyl)butyl]-tosyl-amino]ethyl ester Formula: C24H29NO6S2 MolecularWeight: 491.62016

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CO1)N(CCOS(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC[C@H](C1=CC=CO1)N(CCOS(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H29NO6S2/c1-4-6-23(24-7-5-17-30-24)25(32(26,27)21-12-8-19(2)9-13-21)16-18-31-33(28,29)22-14-10-20(3)11-15-22/h5,7-15,17,23H,4,6,16,18H2,1-3H3/t23-/m1/s1