ethanedioic acid; 5-(2-hydroxyethyl)-3-(4-methoxyphenyl)-4-methyl-2H-pyrano[2,3-c]pyrazol-6-one

Systemtic Name: ethanedioic acid; 5-(2-hydroxyethyl)-3-(4-methoxyphenyl)-4-methyl-2H-pyrano[2,3-c]pyrazol-6-one Openeye Name: 5-(2-hydroxyethyl)-3-(4-methoxyphenyl)-4-methyl-2H-pyrano[2,3-c]pyrazol-6-one; oxalic acid CAS Name: 5-(2-hydroxyethyl)-3-(4-methoxyphenyl)-4-methyl-2H-pyrano[2,3-c]pyrazol-6-one; oxalic acid IUPAC Name: 5-(2-hydroxyethyl)-3-(4-methoxyphenyl)-4-methyl-2H-pyrano[2,3-c]pyrazol-6-one; oxalic acid Traditional Name: 5-(2-hydroxyethyl)-3-(4-methoxyphenyl)-4-methyl-2H-pyrano[2,3-c]pyrazol-6-one; oxalic acid Formula: C18H18N2O8 MolecularWeight: 390.34412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=NNC(=C12)C3=CC=C(C=C3)OC)CCO.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C(=O)OC2=NNC(=C12)C3=CC=C(C=C3)OC)CCO.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H16N2O4.C2H2O4/c1-9-12(7-8-19)16(20)22-15-13(9)14(17-18-15)10-3-5-11(21-2)6-4-10;3-1(4)2(5)6/h3-6,19H,7-8H2,1-2H3,(H,17,18);(H,3,4)(H,5,6)