5-(hydroxymethyl)-1-(methoxymethyl)pyrrole-3-carboxylate

Systemtic Name: 5-(hydroxymethyl)-1-(methoxymethyl)pyrrole-3-carboxylate Openeye Name: 5-(hydroxymethyl)-1-(methoxymethyl)pyrrole-3-carboxylate CAS Name: 5-(hydroxymethyl)-1-(methoxymethyl)-3-pyrrolecarboxylate IUPAC Name: 5-(hydroxymethyl)-1-(methoxymethyl)pyrrole-3-carboxylate Traditional Name: 1-(methoxymethyl)-5-methylol-pyrrole-3-carboxylate Formula: C8H10NO4- MolecularWeight: 184.1693

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCN1C=C(C=C1CO)C(=O)[O-]

Isomeric SMILES

COCN1C=C(C=C1CO)C(=O)[O-]

InChI

InChI=1S/C8H11NO4/c1-13-5-9-3-6(8(11)12)2-7(9)4-10/h2-3,10H,4-5H2,1H3,(H,11,12)/p-1