methyl-(2,3,4-trimethoxy-2,3,4,5-tetrahydro-1H-benzo[7]annulen-6-yl)azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: methyl-(2,3,4-trimethoxy-2,3,4,5-tetrahydro-1H-benzo[7]annulen-6-yl)azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-hydroxy-2-oxo-acetate; methyl-(2,3,4-trimethoxy-2,3,4,5-tetrahydro-1H-benzo[7]annulen-6-yl)ammonium CAS Name: 2-hydroxy-2-oxoacetate; methyl-(2,3,4-trimethoxy-2,3,4,5-tetrahydro-1H-benzo[7]annulen-6-yl)ammonium IUPAC Name: 2-hydroxy-2-oxoacetate; methyl-(2,3,4-trimethoxy-2,3,4,5-tetrahydro-1H-benzo[7]annulen-6-yl)azanium Traditional Name: methyl-(2,3,4-trimethoxy-2,3,4,5-tetrahydro-1H-benzocyclohepten-6-yl)ammonium binoxalate Formula: C32H49N2O10+ MolecularWeight: 621.73886

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]C1=CC=CC2=C(C1)C(C(C(C2)OC)OC)OC.C[NH2+]C1=CC=CC2=C(C1)C(C(C(C2)OC)OC)OC.C(=O)(C(=O)[O-])O

Isomeric SMILES

C[NH2+]C1=CC=CC2=C(C1)C(C(C(C2)OC)OC)OC.C[NH2+]C1=CC=CC2=C(C1)C(C(C(C2)OC)OC)OC.C(=O)(C(=O)[O-])O

InChI

InChI=1S/2C15H23NO3.C2H2O4/c2*1-16-11-7-5-6-10-8-13(17-2)15(19-4)14(18-3)12(10)9-11;3-1(4)2(5)6/h2*5-7,13-16H,8-9H2,1-4H3;(H,3,4)(H,5,6)/p+1