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3-methyl-4-(methylamino)-5-oxidanyl-naphthalene-1-sulfonic acid

3-methyl-4-(methylamino)-5-oxidanyl-naphthalene-1-sulfonic acid

Systemtic Name:3-methyl-4-(methylamino)-5-oxidanyl-naphthalene-1-sulfonic acid
Openeye Name:5-hydroxy-3-methyl-4-(methylamino)naphthalene-1-sulfonic acid
CAS Name:5-hydroxy-3-methyl-4-(methylamino)-1-naphthalenesulfonic acid
IUPAC Name:5-hydroxy-3-methyl-4-(methylamino)naphthalene-1-sulfonic acid
Traditional Name:5-hydroxy-3-methyl-4-(methylamino)naphthalene-1-sulfonic acid
Formula: C12H13NO4S
MolecularWeight: 267.30092
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=CC=C(C2=C1NC)O)S(=O)(=O)O


Isomeric SMILES

CC1=CC(=C2C=CC=C(C2=C1NC)O)S(=O)(=O)O


InChI

InChI=1S/C12H13NO4S/c1-7-6-10(18(15,16)17)8-4-3-5-9(14)11(8)12(7)13-2/h3-6,13-14H,1-2H3,(H,15,16,17)


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