dimethyl (2S,3R)-2-dimethoxyphosphoryl-3-(1-methoxy-3-oxidanylidene-inden-2-yl)butanedioate

Systemtic Name: dimethyl (2S,3R)-2-dimethoxyphosphoryl-3-(1-methoxy-3-oxidanylidene-inden-2-yl)butanedioate Openeye Name: dimethyl (2S,3R)-2-dimethoxyphosphoryl-3-(1-methoxy-3-oxo-inden-2-yl)butanedioate CAS Name: (2S,3R)-2-dimethoxyphosphoryl-3-(1-methoxy-3-oxo-2-indenyl)butanedioic acid dimethyl ester IUPAC Name: dimethyl (2S,3R)-2-dimethoxyphosphoryl-3-(1-methoxy-3-oxoinden-2-yl)butanedioate Traditional Name: (2S,3R)-2-dimethoxyphosphoryl-3-(1-keto-3-methoxy-inden-2-yl)succinic acid dimethyl ester Formula: C18H21O9P MolecularWeight: 412.327701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C2=CC=CC=C21)C(C(C(=O)OC)P(=O)(OC)OC)C(=O)OC

Isomeric SMILES

COC1=C(C(=O)C2=CC=CC=C21)[C@@H]([C@@H](C(=O)OC)P(=O)(OC)OC)C(=O)OC

InChI

InChI=1S/C18H21O9P/c1-23-15-11-9-7-6-8-10(11)14(19)12(15)13(17(20)24-2)16(18(21)25-3)28(22,26-4)27-5/h6-9,13,16H,1-5H3/t13-,16-/m0/s1