4-[[6-[(5-methylfuran-2-yl)sulfonyl-propan-2-yl-amino]-2,3-dihydro-1H-inden-5-yl]oxymethyl]benzoic acid

Systemtic Name: 4-[[6-[(5-methylfuran-2-yl)sulfonyl-propan-2-yl-amino]-2,3-dihydro-1H-inden-5-yl]oxymethyl]benzoic acid Openeye Name: 4-[[6-[isopropyl-[(5-methyl-2-furyl)sulfonyl]amino]indan-5-yl]oxymethyl]benzoic acid CAS Name: 4-[[6-[(5-methyl-2-furanyl)sulfonyl-propan-2-ylamino]-2,3-dihydro-1H-inden-5-yl]oxymethyl]benzoic acid IUPAC Name: 4-[[6-[(5-methylfuran-2-yl)sulfonyl-propan-2-ylamino]-2,3-dihydro-1H-inden-5-yl]oxymethyl]benzoic acid Traditional Name: 4-[[6-[isopropyl-[(5-methyl-2-furyl)sulfonyl]amino]indan-5-yl]oxymethyl]benzoic acid Formula: C25H27NO6S MolecularWeight: 469.54998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)S(=O)(=O)N(C2=C(C=C3CCCC3=C2)OCC4=CC=C(C=C4)C(=O)O)C(C)C

Isomeric SMILES

CC1=CC=C(O1)S(=O)(=O)N(C2=C(C=C3CCCC3=C2)OCC4=CC=C(C=C4)C(=O)O)C(C)C

InChI

InChI=1S/C25H27NO6S/c1-16(2)26(33(29,30)24-12-7-17(3)32-24)22-13-20-5-4-6-21(20)14-23(22)31-15-18-8-10-19(11-9-18)25(27)28/h7-14,16H,4-6,15H2,1-3H3,(H,27,28)