5-chloranyl-2-methyl-8-oxidanyl-1,2,3,4-tetrahydroquinoline-7-sulfonic acid

Systemtic Name: 5-chloranyl-2-methyl-8-oxidanyl-1,2,3,4-tetrahydroquinoline-7-sulfonic acid Openeye Name: 5-chloro-8-hydroxy-2-methyl-1,2,3,4-tetrahydroquinoline-7-sulfonic acid CAS Name: 5-chloro-8-hydroxy-2-methyl-1,2,3,4-tetrahydroquinoline-7-sulfonic acid IUPAC Name: 5-chloro-8-hydroxy-2-methyl-1,2,3,4-tetrahydroquinoline-7-sulfonic acid Traditional Name: 5-chloro-8-hydroxy-2-methyl-1,2,3,4-tetrahydroquinoline-7-sulfonic acid Formula: C10H12ClNO4S MolecularWeight: 277.72458

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C=C(C(=C2N1)O)S(=O)(=O)O)Cl

Isomeric SMILES

CC1CCC2=C(C=C(C(=C2N1)O)S(=O)(=O)O)Cl

InChI

InChI=1S/C10H12ClNO4S/c1-5-2-3-6-7(11)4-8(17(14,15)16)10(13)9(6)12-5/h4-5,12-13H,2-3H2,1H3,(H,14,15,16)