4-chloranyl-2-(furan-3-ylmethylamino)-5-propan-2-ylsulfinyl-benzoic acid

Systemtic Name: 4-chloranyl-2-(furan-3-ylmethylamino)-5-propan-2-ylsulfinyl-benzoic acid Openeye Name: 4-chloro-2-(3-furylmethylamino)-5-isopropylsulfinyl-benzoic acid CAS Name: 4-chloro-2-(3-furanylmethylamino)-5-propan-2-ylsulfinylbenzoic acid IUPAC Name: 4-chloro-2-(furan-3-ylmethylamino)-5-propan-2-ylsulfinylbenzoic acid Traditional Name: 4-chloro-2-(3-furfurylamino)-5-isopropylsulfinyl-benzoic acid Formula: C15H16ClNO4S MolecularWeight: 341.80984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)C1=C(C=C(C(=C1)C(=O)O)NCC2=COC=C2)Cl

Isomeric SMILES

CC(C)S(=O)C1=C(C=C(C(=C1)C(=O)O)NCC2=COC=C2)Cl

InChI

InChI=1S/C15H16ClNO4S/c1-9(2)22(20)14-5-11(15(18)19)13(6-12(14)16)17-7-10-3-4-21-8-10/h3-6,8-9,17H,7H2,1-2H3,(H,18,19)