2,3-bis(phenylcarbonyloxy)butanedioic acid; 1-(1,3-dioxan-5-yl)-N,N-dimethyl-1-phenyl-methanamine

Systemtic Name: 2,3-bis(phenylcarbonyloxy)butanedioic acid; 1-(1,3-dioxan-5-yl)-N,N-dimethyl-1-phenyl-methanamine Openeye Name: 2,3-dibenzoyloxybutanedioic acid; 1-(1,3-dioxan-5-yl)-N,N-dimethyl-1-phenyl-methanamine CAS Name: 2,3-dibenzoyloxybutanedioic acid; 1-(1,3-dioxan-5-yl)-N,N-dimethyl-1-phenylmethanamine IUPAC Name: 2,3-dibenzoyloxybutanedioic acid; 1-(1,3-dioxan-5-yl)-N,N-dimethyl-1-phenylmethanamine Traditional Name: 2,3-dibenzoyloxysuccinic acid; [1,3-dioxan-5-yl(phenyl)methyl]-dimethyl-amine Formula: C31H33NO10 MolecularWeight: 579.59442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(C1COCOC1)C2=CC=CC=C2.C1=CC=C(C=C1)C(=O)OC(C(C(=O)O)OC(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CN(C)C(C1COCOC1)C2=CC=CC=C2.C1=CC=C(C=C1)C(=O)OC(C(C(=O)O)OC(=O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H14O8.C13H19NO2/c19-15(20)13(25-17(23)11-7-3-1-4-8-11)14(16(21)22)26-18(24)12-9-5-2-6-10-12;1-14(2)13(11-6-4-3-5-7-11)12-8-15-10-16-9-12/h1-10,13-14H,(H,19,20)(H,21,22);3-7,12-13H,8-10H2,1-2H3