4-[[3-[(5-methylfuran-2-yl)sulfonyl-propan-2-yl-amino]naphthalen-2-yl]oxymethyl]benzoic acid

Systemtic Name: 4-[[3-[(5-methylfuran-2-yl)sulfonyl-propan-2-yl-amino]naphthalen-2-yl]oxymethyl]benzoic acid Openeye Name: 4-[[3-[isopropyl-[(5-methyl-2-furyl)sulfonyl]amino]-2-naphthyl]oxymethyl]benzoic acid CAS Name: 4-[[3-[(5-methyl-2-furanyl)sulfonyl-propan-2-ylamino]-2-naphthalenyl]oxymethyl]benzoic acid IUPAC Name: 4-[[3-[(5-methylfuran-2-yl)sulfonyl-propan-2-ylamino]naphthalen-2-yl]oxymethyl]benzoic acid Traditional Name: 4-[[3-[isopropyl-[(5-methyl-2-furyl)sulfonyl]amino]-2-naphthoxy]methyl]benzoic acid Formula: C26H25NO6S MolecularWeight: 479.5448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)S(=O)(=O)N(C2=CC3=CC=CC=C3C=C2OCC4=CC=C(C=C4)C(=O)O)C(C)C

Isomeric SMILES

CC1=CC=C(O1)S(=O)(=O)N(C2=CC3=CC=CC=C3C=C2OCC4=CC=C(C=C4)C(=O)O)C(C)C

InChI

InChI=1S/C26H25NO6S/c1-17(2)27(34(30,31)25-13-8-18(3)33-25)23-14-21-6-4-5-7-22(21)15-24(23)32-16-19-9-11-20(12-10-19)26(28)29/h4-15,17H,16H2,1-3H3,(H,28,29)