methyl (3R)-7-[(4-methoxyphenyl)methyl-(4-methylphenyl)sulfonyl-amino]-3-oxidanyl-heptanoate

Systemtic Name: methyl (3R)-7-[(4-methoxyphenyl)methyl-(4-methylphenyl)sulfonyl-amino]-3-oxidanyl-heptanoate Openeye Name: methyl (3R)-3-hydroxy-7-[(4-methoxyphenyl)methyl-(p-tolylsulfonyl)amino]heptanoate CAS Name: (3R)-3-hydroxy-7-[(4-methoxyphenyl)methyl-(4-methylphenyl)sulfonylamino]heptanoic acid methyl ester IUPAC Name: methyl (3R)-3-hydroxy-7-[(4-methoxyphenyl)methyl-(4-methylphenyl)sulfonylamino]heptanoate Traditional Name: (3R)-3-hydroxy-7-[p-anisyl(tosyl)amino]enanthic acid methyl ester Formula: C23H31NO6S MolecularWeight: 449.56034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCCCC(CC(=O)OC)O)CC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCCC[C@H](CC(=O)OC)O)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C23H31NO6S/c1-18-7-13-22(14-8-18)31(27,28)24(17-19-9-11-21(29-2)12-10-19)15-5-4-6-20(25)16-23(26)30-3/h7-14,20,25H,4-6,15-17H2,1-3H3/t20-/m1/s1