pyrido[3,2-g]quinoline-2,8-dicarboxylate; tris(hydroxymethyl)-methyl-azanium

Systemtic Name: pyrido[3,2-g]quinoline-2,8-dicarboxylate; tris(hydroxymethyl)-methyl-azanium Openeye Name: pyrido[3,2-g]quinoline-2,8-dicarboxylate; tris(hydroxymethyl)-methyl-ammonium CAS Name: pyrido[3,2-g]quinoline-2,8-dicarboxylate; tris(hydroxymethyl)-methylammonium IUPAC Name: pyrido[3,2-g]quinoline-2,8-dicarboxylate; tris(hydroxymethyl)-methylazanium Traditional Name: methyl(trimethylol)ammonium; pyrido[3,2-g]quinoline-2,8-dicarboxylate Formula: C22H30N4O10 MolecularWeight: 510.4944

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](CO)(CO)CO.C[N+](CO)(CO)CO.C1=CC(=NC2=CC3=C(C=CC(=N3)C(=O)[O-])C=C21)C(=O)[O-]

Isomeric SMILES

C[N+](CO)(CO)CO.C[N+](CO)(CO)CO.C1=CC(=NC2=CC3=C(C=CC(=N3)C(=O)[O-])C=C21)C(=O)[O-]

InChI

InChI=1S/C14H8N2O4.2C4H12NO3/c17-13(18)9-3-1-7-5-8-2-4-10(14(19)20)16-12(8)6-11(7)15-9;2*1-5(2-6,3-7)4-8/h1-6H,(H,17,18)(H,19,20);2*6-8H,2-4H2,1H3/q;2*+1/p-2