2-[2-[3-(dimethylamino)propoxy]-4-methoxy-phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[2-[3-(dimethylamino)propoxy]-4-methoxy-phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[2-[3-(dimethylamino)propoxy]-4-methoxy-phenyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[2-[3-(dimethylamino)propoxy]-4-methoxyphenyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[2-[3-(dimethylamino)propoxy]-4-methoxyphenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[2-[3-(dimethylamino)propoxy]-4-methoxy-phenyl]-4-methyl-thiazole-5-carboxylic acid Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=C(C=C(C=C2)OC)OCCCN(C)C)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)C2=C(C=C(C=C2)OC)OCCCN(C)C)C(=O)O

InChI

InChI=1S/C17H22N2O4S/c1-11-15(17(20)21)24-16(18-11)13-7-6-12(22-4)10-14(13)23-9-5-8-19(2)3/h6-7,10H,5,8-9H2,1-4H3,(H,20,21)