3-methoxy-4-[[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]methoxy]benzoic acid

Systemtic Name: 3-methoxy-4-[[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]methoxy]benzoic acid Openeye Name: 3-methoxy-4-[[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]methoxy]benzoic acid CAS Name: 3-methoxy-4-[[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]methoxy]benzoic acid IUPAC Name: 3-methoxy-4-[[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]methoxy]benzoic acid Traditional Name: 3-methoxy-4-[[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]methoxy]benzoic acid Formula: C17H19NO4S MolecularWeight: 333.40206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=N2)COC3=C(C=C(C=C3)C(=O)O)OC

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=N2)COC3=C(C=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C17H19NO4S/c1-10-3-5-12-15(7-10)23-16(18-12)9-22-13-6-4-11(17(19)20)8-14(13)21-2/h4,6,8,10H,3,5,7,9H2,1-2H3,(H,19,20)/t10-/m0/s1