propyl 4-azanyl-1-oxidanyl-cyclohexa-2,4-diene-1-sulfonate

Systemtic Name: propyl 4-azanyl-1-oxidanyl-cyclohexa-2,4-diene-1-sulfonate Openeye Name: propyl 4-amino-1-hydroxy-cyclohexa-2,4-diene-1-sulfonate CAS Name: 4-amino-1-hydroxy-1-cyclohexa-2,4-dienesulfonic acid propyl ester IUPAC Name: propyl 4-amino-1-hydroxycyclohexa-2,4-diene-1-sulfonate Traditional Name: 4-amino-1-hydroxy-cyclohexa-2,4-diene-1-sulfonic acid propyl ester Formula: C9H15NO4S MolecularWeight: 233.2847

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Descriptors Computed from Structure

Canonical SMILES:

CCCOS(=O)(=O)C1(CC=C(C=C1)N)O

Isomeric SMILES

CCCOS(=O)(=O)C1(CC=C(C=C1)N)O

InChI

InChI=1S/C9H15NO4S/c1-2-7-14-15(12,13)9(11)5-3-8(10)4-6-9/h3-5,11H,2,6-7,10H2,1H3