4-[2-(cyclobutylcarbonylamino)-4-piperidin-1-ylsulfonyl-phenoxy]benzoic acid

Systemtic Name: 4-[2-(cyclobutylcarbonylamino)-4-piperidin-1-ylsulfonyl-phenoxy]benzoic acid Openeye Name: 4-[2-(cyclobutanecarbonylamino)-4-(1-piperidylsulfonyl)phenoxy]benzoic acid CAS Name: 4-[2-[[cyclobutyl(oxo)methyl]amino]-4-(1-piperidinylsulfonyl)phenoxy]benzoic acid IUPAC Name: 4-[2-(cyclobutanecarbonylamino)-4-piperidin-1-ylsulfonylphenoxy]benzoic acid Traditional Name: 4-[2-(cyclobutanecarbonylamino)-4-piperidinosulfonyl-phenoxy]benzoic acid Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)C(=O)O)NC(=O)C4CCC4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)C(=O)O)NC(=O)C4CCC4

InChI

InChI=1S/C23H26N2O6S/c26-22(16-5-4-6-16)24-20-15-19(32(29,30)25-13-2-1-3-14-25)11-12-21(20)31-18-9-7-17(8-10-18)23(27)28/h7-12,15-16H,1-6,13-14H2,(H,24,26)(H,27,28)