methyl 4-[2-[(3-methylfuran-2-yl)carbonylamino]-4-piperidin-1-ylsulfonyl-phenoxy]benzoate

Systemtic Name: methyl 4-[2-[(3-methylfuran-2-yl)carbonylamino]-4-piperidin-1-ylsulfonyl-phenoxy]benzoate Openeye Name: methyl 4-[2-[(3-methylfuran-2-carbonyl)amino]-4-(1-piperidylsulfonyl)phenoxy]benzoate CAS Name: 4-[2-[[(3-methyl-2-furanyl)-oxomethyl]amino]-4-(1-piperidinylsulfonyl)phenoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(3-methylfuran-2-carbonyl)amino]-4-piperidin-1-ylsulfonylphenoxy]benzoate Traditional Name: 4-[2-[(3-methyl-2-furoyl)amino]-4-piperidinosulfonyl-phenoxy]benzoic acid methyl ester Formula: C25H26N2O7S MolecularWeight: 498.54814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=C(OC=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C25H26N2O7S/c1-17-12-15-33-23(17)24(28)26-21-16-20(35(30,31)27-13-4-3-5-14-27)10-11-22(21)34-19-8-6-18(7-9-19)25(29)32-2/h6-12,15-16H,3-5,13-14H2,1-2H3,(H,26,28)