3-[[4-acetamido-2-(1-indazol-1-ylpropan-2-yloxy)phenyl]sulfonylamino]-4,4-diethoxy-butanoic acid

Systemtic Name: 3-[[4-acetamido-2-(1-indazol-1-ylpropan-2-yloxy)phenyl]sulfonylamino]-4,4-diethoxy-butanoic acid Openeye Name: 3-[[4-acetamido-2-(2-indazol-1-yl-1-methyl-ethoxy)phenyl]sulfonylamino]-4,4-diethoxy-butanoic acid CAS Name: 3-[[4-acetamido-2-[1-(1-indazolyl)propan-2-yloxy]phenyl]sulfonylamino]-4,4-diethoxybutanoic acid IUPAC Name: 3-[[4-acetamido-2-(1-indazol-1-ylpropan-2-yloxy)phenyl]sulfonylamino]-4,4-diethoxybutanoic acid Traditional Name: 3-[[4-acetamido-2-(2-indazol-1-yl-1-methyl-ethoxy)phenyl]sulfonylamino]-4,4-diethoxy-butyric acid Formula: C26H34N4O8S MolecularWeight: 562.63516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(CC(=O)O)NS(=O)(=O)C1=C(C=C(C=C1)NC(=O)C)OC(C)CN2C3=CC=CC=C3C=N2)OCC

Isomeric SMILES

CCOC(C(CC(=O)O)NS(=O)(=O)C1=C(C=C(C=C1)NC(=O)C)OC(C)CN2C3=CC=CC=C3C=N2)OCC

InChI

InChI=1S/C26H34N4O8S/c1-5-36-26(37-6-2)21(14-25(32)33)29-39(34,35)24-12-11-20(28-18(4)31)13-23(24)38-17(3)16-30-22-10-8-7-9-19(22)15-27-30/h7-13,15,17,21,26,29H,5-6,14,16H2,1-4H3,(H,28,31)(H,32,33)