5-methyl-N-propyl-furan-2-sulfonamide; 3,4,5-trimethyl-2-(phenoxymethyl)benzoic acid

Systemtic Name: 5-methyl-N-propyl-furan-2-sulfonamide; 3,4,5-trimethyl-2-(phenoxymethyl)benzoic acid Openeye Name: 5-methyl-N-propyl-furan-2-sulfonamide; 3,4,5-trimethyl-2-(phenoxymethyl)benzoic acid CAS Name: 5-methyl-N-propyl-2-furansulfonamide; 3,4,5-trimethyl-2-(phenoxymethyl)benzoic acid IUPAC Name: 5-methyl-N-propylfuran-2-sulfonamide; 3,4,5-trimethyl-2-(phenoxymethyl)benzoic acid Traditional Name: 5-methyl-N-propyl-furan-2-sulfonamide; 3,4,5-trimethyl-2-(phenoxymethyl)benzoic acid Formula: C25H31NO6S MolecularWeight: 473.58174

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC=C(O1)C.CC1=C(C(=C(C(=C1)C(=O)O)COC2=CC=CC=C2)C)C

Isomeric SMILES

CCCNS(=O)(=O)C1=CC=C(O1)C.CC1=C(C(=C(C(=C1)C(=O)O)COC2=CC=CC=C2)C)C

InChI

InChI=1S/C17H18O3.C8H13NO3S/c1-11-9-15(17(18)19)16(13(3)12(11)2)10-20-14-7-5-4-6-8-14;1-3-6-9-13(10,11)8-5-4-7(2)12-8/h4-9H,10H2,1-3H3,(H,18,19);4-5,9H,3,6H2,1-2H3