4-(2-methanoylpyrimidin-4-yl)piperazine-1-sulfonic acid

Systemtic Name: 4-(2-methanoylpyrimidin-4-yl)piperazine-1-sulfonic acid Openeye Name: 4-(2-formylpyrimidin-4-yl)piperazine-1-sulfonic acid CAS Name: 4-(2-formyl-4-pyrimidinyl)-1-piperazinesulfonic acid IUPAC Name: 4-(2-formylpyrimidin-4-yl)piperazine-1-sulfonic acid Traditional Name: 4-(2-formylpyrimidin-4-yl)piperazine-1-sulfonic acid Formula: C9H12N4O4S MolecularWeight: 272.28098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=NC=C2)C=O)S(=O)(=O)O

Isomeric SMILES

C1CN(CCN1C2=NC(=NC=C2)C=O)S(=O)(=O)O

InChI

InChI=1S/C9H12N4O4S/c14-7-8-10-2-1-9(11-8)12-3-5-13(6-4-12)18(15,16)17/h1-2,7H,3-6H2,(H,15,16,17)