4-(3-methyl-2-morpholin-4-yl-1-benzothiophen-5-yl)benzoic acid

Systemtic Name: 4-(3-methyl-2-morpholin-4-yl-1-benzothiophen-5-yl)benzoic acid Openeye Name: 4-(3-methyl-2-morpholino-benzothiophen-5-yl)benzoic acid CAS Name: 4-[3-methyl-2-(4-morpholinyl)-1-benzothiophen-5-yl]benzoic acid IUPAC Name: 4-(3-methyl-2-morpholin-4-yl-1-benzothiophen-5-yl)benzoic acid Traditional Name: 4-(3-methyl-2-morpholino-benzothiophen-5-yl)benzoic acid Formula: C20H19NO3S MolecularWeight: 353.43476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)C3=CC=C(C=C3)C(=O)O)N4CCOCC4

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)C3=CC=C(C=C3)C(=O)O)N4CCOCC4

InChI

InChI=1S/C20H19NO3S/c1-13-17-12-16(14-2-4-15(5-3-14)20(22)23)6-7-18(17)25-19(13)21-8-10-24-11-9-21/h2-7,12H,8-11H2,1H3,(H,22,23)