methyl (1R,3R,4S,5R)-3,4-diacetyloxy-5-(2-acetyloxyethoxy)-1-[[di(propan-2-yl)amino]-phenylmethoxy-phosphanyl]oxy-cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,3R,4S,5R)-3,4-diacetyloxy-5-(2-acetyloxyethoxy)-1-[[di(propan-2-yl)amino]-phenylmethoxy-phosphanyl]oxy-cyclohexane-1-carboxylate Openeye Name: methyl (1R,3R,4S,5R)-3,4-diacetoxy-5-(2-acetoxyethoxy)-1-[benzyloxy-(diisopropylamino)phosphanyl]oxy-cyclohexanecarboxylate CAS Name: (1R,3R,4S,5R)-3,4-diacetyloxy-5-(2-acetyloxyethoxy)-1-[[di(propan-2-yl)amino]-phenylmethoxyphosphino]oxy-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,3R,4S,5R)-3,4-diacetyloxy-5-(2-acetyloxyethoxy)-1-[[di(propan-2-yl)amino]-phenylmethoxyphosphanyl]oxycyclohexane-1-carboxylate Traditional Name: (1R,3R,4S,5R)-3,4-diacetoxy-5-(2-acetoxyethoxy)-1-[benzoxy-(diisopropylamino)phosphino]oxy-cyclohexanecarboxylic acid methyl ester Formula: C29H44NO11P MolecularWeight: 613.633521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)P(OCC1=CC=CC=C1)OC2(CC(C(C(C2)OC(=O)C)OC(=O)C)OCCOC(=O)C)C(=O)OC

Isomeric SMILES

CC(C)N(C(C)C)P(OCC1=CC=CC=C1)O[C@@]2(C[C@H]([C@@H]([C@@H](C2)OC(=O)C)OC(=O)C)OCCOC(=O)C)C(=O)OC

InChI

InChI=1S/C29H44NO11P/c1-19(2)30(20(3)4)42(38-18-24-12-10-9-11-13-24)41-29(28(34)35-8)16-25(37-15-14-36-21(5)31)27(40-23(7)33)26(17-29)39-22(6)32/h9-13,19-20,25-27H,14-18H2,1-8H3/t25-,26-,27+,29-,42?/m1/s1