3-methyl-2-(naphthalen-2-yloxymethyl)benzoic acid; 4-methyl-N-propan-2-yl-1,3-thiazole-2-sulfonamide

Systemtic Name: 3-methyl-2-(naphthalen-2-yloxymethyl)benzoic acid; 4-methyl-N-propan-2-yl-1,3-thiazole-2-sulfonamide Openeye Name: N-isopropyl-4-methyl-thiazole-2-sulfonamide; 3-methyl-2-(2-naphthyloxymethyl)benzoic acid CAS Name: 3-methyl-2-(2-naphthalenyloxymethyl)benzoic acid; 4-methyl-N-propan-2-yl-2-thiazolesulfonamide IUPAC Name: 3-methyl-2-(naphthalen-2-yloxymethyl)benzoic acid; 4-methyl-N-propan-2-yl-1,3-thiazole-2-sulfonamide Traditional Name: N-isopropyl-4-methyl-thiazole-2-sulfonamide; 3-methyl-2-(2-naphthoxymethyl)benzoic acid Formula: C26H28N2O5S2 MolecularWeight: 512.64092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1COC2=CC3=CC=CC=C3C=C2)C(=O)O.CC1=CSC(=N1)S(=O)(=O)NC(C)C

Isomeric SMILES

CC1=CC=CC(=C1COC2=CC3=CC=CC=C3C=C2)C(=O)O.CC1=CSC(=N1)S(=O)(=O)NC(C)C

InChI

InChI=1S/C19H16O3.C7H12N2O2S2/c1-13-5-4-8-17(19(20)21)18(13)12-22-16-10-9-14-6-2-3-7-15(14)11-16;1-5(2)9-13(10,11)7-8-6(3)4-12-7/h2-11H,12H2,1H3,(H,20,21);4-5,9H,1-3H3