methyl 4-[2-oxidanyl-3-[4-(thiophen-2-ylcarbonylamino)phenoxy]propoxy]benzoate

Systemtic Name: methyl 4-[2-oxidanyl-3-[4-(thiophen-2-ylcarbonylamino)phenoxy]propoxy]benzoate Openeye Name: methyl 4-[2-hydroxy-3-[4-(thiophene-2-carbonylamino)phenoxy]propoxy]benzoate CAS Name: 4-[2-hydroxy-3-[4-[[oxo(thiophen-2-yl)methyl]amino]phenoxy]propoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-hydroxy-3-[4-(thiophene-2-carbonylamino)phenoxy]propoxy]benzoate Traditional Name: 4-[2-hydroxy-3-[4-(2-thenoylamino)phenoxy]propoxy]benzoic acid methyl ester Formula: C22H21NO6S MolecularWeight: 427.47024

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(COC2=CC=C(C=C2)NC(=O)C3=CC=CS3)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(COC2=CC=C(C=C2)NC(=O)C3=CC=CS3)O

InChI

InChI=1S/C22H21NO6S/c1-27-22(26)15-4-8-18(9-5-15)28-13-17(24)14-29-19-10-6-16(7-11-19)23-21(25)20-3-2-12-30-20/h2-12,17,24H,13-14H2,1H3,(H,23,25)