4,4-bis(azanyl)-3-methyl-cyclohexa-1,5-diene-1-sulfonic acid

Systemtic Name: 4,4-bis(azanyl)-3-methyl-cyclohexa-1,5-diene-1-sulfonic acid Openeye Name: 4,4-diamino-3-methyl-cyclohexa-1,5-diene-1-sulfonic acid CAS Name: 4,4-diamino-3-methyl-1-cyclohexa-1,5-dienesulfonic acid IUPAC Name: 4,4-diamino-3-methylcyclohexa-1,5-diene-1-sulfonic acid Traditional Name: 4,4-diamino-3-methyl-cyclohexa-1,5-diene-1-sulfonic acid Formula: C7H12N2O3S MolecularWeight: 204.24678

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(C=CC1(N)N)S(=O)(=O)O

Isomeric SMILES

CC1C=C(C=CC1(N)N)S(=O)(=O)O

InChI

InChI=1S/C7H12N2O3S/c1-5-4-6(13(10,11)12)2-3-7(5,8)9/h2-5H,8-9H2,1H3,(H,10,11,12)