(2R,3R)-2,3-bis(4-methylbenzoyloxy)butanedioic acid; bis((3R,4R)-1-benzyl-N,4-dimethylpiperidin-3-amine)

CAS: 477600-71-8

Formula: C48H62N4O8

SMILES: CN[C@H]1CN(CC2=CC=CC=C2)CC[C@H]1C.CN[C@H]1CN(CC2=CC=CC=C2)CC[C@H]1C.CC1=CC=C(C=C1)C(=O)O[C@H]([C@@H](OC(=O)C1=CC=C(C)C=C1)C(O)=O)C(O)=O

IUPAC: (2R,3R)-2,3-bis(4-methylbenzoyloxy)butanedioic acid; bis((3R,4R)-1-benzyl-N,4-dimethylpiperidin-3-amine)

InChI: InChI=1S/C20H18O8.2C14H22N2/c1-11-3-7-13(8-4-11)19(25)27-15(17(21)22)16(18(23)24)28-20(26)14-9-5-12(2)6-10-14;2*1-12-8-9-16(11-14(12)15-2)10-13-6-4-3-5-7-13/h3-10,15-16H,1-2H3,(H,21,22)(H,23,24);2*3-7,12,14-15H,8-11H2,1-2H3/t15-,16-;2*12-,14+/m111/s1

Composition: C (70.05%), H (7.59%), N (6.81%), O (15.55%)

Molar Mass: 823.044

Atom Count: 122

Heavy Atom Count: 60