ethanedioic acid; ethyl 3-(2-azanylethyl)-2H-indazole-5-carboxylate

Systemtic Name: ethanedioic acid; ethyl 3-(2-azanylethyl)-2H-indazole-5-carboxylate Openeye Name: ethyl 3-(2-aminoethyl)-2H-indazole-5-carboxylate; oxalic acid CAS Name: 3-(2-aminoethyl)-2H-indazole-5-carboxylic acid ethyl ester; oxalic acid IUPAC Name: ethyl 3-(2-aminoethyl)-2H-indazole-5-carboxylate; oxalic acid Traditional Name: 3-(2-aminoethyl)-2H-indazole-5-carboxylic acid ethyl ester; oxalic acid Formula: C14H17N3O6 MolecularWeight: 323.30128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(NN=C2C=C1)CCN.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)C1=CC2=C(NN=C2C=C1)CCN.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H15N3O2.C2H2O4/c1-2-17-12(16)8-3-4-10-9(7-8)11(5-6-13)15-14-10;3-1(4)2(5)6/h3-4,7H,2,5-6,13H2,1H3,(H,14,15);(H,3,4)(H,5,6)