[(3R)-8-(2,6-dimethoxyphenyl)-3,4-dihydro-2H-chromen-3-yl]-dipropyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: [(3R)-8-(2,6-dimethoxyphenyl)-3,4-dihydro-2H-chromen-3-yl]-dipropyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: [(3R)-8-(2,6-dimethoxyphenyl)chroman-3-yl]-dipropyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: [(3R)-8-(2,6-dimethoxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl]-dipropylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: [(3R)-8-(2,6-dimethoxyphenyl)-3,4-dihydro-2H-chromen-3-yl]-dipropylazanium; 2-hydroxy-2-oxoacetate Traditional Name: [(3R)-8-(2,6-dimethoxyphenyl)chroman-3-yl]-dipropyl-ammonium binoxalate Formula: C25H33NO7 MolecularWeight: 459.53202

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)C1CC2=CC=CC(=C2OC1)C3=C(C=CC=C3OC)OC.C(=O)(C(=O)[O-])O

Isomeric SMILES

CCC[NH+](CCC)[C@@H]1CC2=CC=CC(=C2OC1)C3=C(C=CC=C3OC)OC.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C23H31NO3.C2H2O4/c1-5-13-24(14-6-2)18-15-17-9-7-10-19(23(17)27-16-18)22-20(25-3)11-8-12-21(22)26-4;3-1(4)2(5)6/h7-12,18H,5-6,13-16H2,1-4H3;(H,3,4)(H,5,6)/t18-;/m1./s1