2-methyl-1H-perimidine-6-sulfonic acid

Systemtic Name: 2-methyl-1H-perimidine-6-sulfonic acid Openeye Name: 2-methyl-1H-perimidine-6-sulfonic acid CAS Name: 2-methyl-1H-perimidine-6-sulfonic acid IUPAC Name: 2-methyl-1H-perimidine-6-sulfonic acid Traditional Name: 2-methyl-1H-perimidine-6-sulfonic acid Formula: C12H10N2O3S MolecularWeight: 262.2844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C3C(=C(C=C2)S(=O)(=O)O)C=CC=C3N1

Isomeric SMILES

CC1=NC2=C3C(=C(C=C2)S(=O)(=O)O)C=CC=C3N1

InChI

InChI=1S/C12H10N2O3S/c1-7-13-9-4-2-3-8-11(18(15,16)17)6-5-10(14-7)12(8)9/h2-6H,1H3,(H,13,14)(H,15,16,17)