methyl 2,2-dimethyl-6-(4-thiophen-2-ylquinolin-2-yl)oxy-hexanoate

Systemtic Name: methyl 2,2-dimethyl-6-(4-thiophen-2-ylquinolin-2-yl)oxy-hexanoate Openeye Name: methyl 2,2-dimethyl-6-[[4-(2-thienyl)-2-quinolyl]oxy]hexanoate CAS Name: 2,2-dimethyl-6-[(4-thiophen-2-yl-2-quinolinyl)oxy]hexanoic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-6-(4-thiophen-2-ylquinolin-2-yl)oxyhexanoate Traditional Name: 2,2-dimethyl-6-[[4-(2-thienyl)-2-quinolyl]oxy]hexanoic acid methyl ester Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCOC1=NC2=CC=CC=C2C(=C1)C3=CC=CS3)C(=O)OC

Isomeric SMILES

CC(C)(CCCCOC1=NC2=CC=CC=C2C(=C1)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C22H25NO3S/c1-22(2,21(24)25-3)12-6-7-13-26-20-15-17(19-11-8-14-27-19)16-9-4-5-10-18(16)23-20/h4-5,8-11,14-15H,6-7,12-13H2,1-3H3