3-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanyl-propane-1-sulfonic acid

Systemtic Name: 3-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanyl-propane-1-sulfonic acid Openeye Name: 3-(5-chloro-2-methoxy-anilino)-2-hydroxy-propane-1-sulfonic acid CAS Name: 3-(5-chloro-2-methoxyanilino)-2-hydroxy-1-propanesulfonic acid IUPAC Name: 3-(5-chloro-2-methoxyanilino)-2-hydroxypropane-1-sulfonic acid Traditional Name: 3-(5-chloro-2-methoxy-anilino)-2-hydroxy-propane-1-sulfonic acid Formula: C10H14ClNO5S MolecularWeight: 295.73986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NCC(CS(=O)(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NCC(CS(=O)(=O)O)O

InChI

InChI=1S/C10H14ClNO5S/c1-17-10-3-2-7(11)4-9(10)12-5-8(13)6-18(14,15)16/h2-4,8,12-13H,5-6H2,1H3,(H,14,15,16)