methyl 3-[3-(2,1-benzothiazol-5-yl)-4-cyclopentyloxy-phenyl]propanoate

Systemtic Name: methyl 3-[3-(2,1-benzothiazol-5-yl)-4-cyclopentyloxy-phenyl]propanoate Openeye Name: methyl 3-[3-(2,1-benzothiazol-5-yl)-4-(cyclopentoxy)phenyl]propanoate CAS Name: 3-[3-(2,1-benzothiazol-5-yl)-4-cyclopentyloxyphenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-(2,1-benzothiazol-5-yl)-4-cyclopentyloxyphenyl]propanoate Traditional Name: 3-[3-(2,1-benzothiazol-5-yl)-4-(cyclopentoxy)phenyl]propionic acid methyl ester Formula: C22H23NO3S MolecularWeight: 381.48792

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC(=C(C=C1)OC2CCCC2)C3=CC4=CSN=C4C=C3

Isomeric SMILES

COC(=O)CCC1=CC(=C(C=C1)OC2CCCC2)C3=CC4=CSN=C4C=C3

InChI

InChI=1S/C22H23NO3S/c1-25-22(24)11-7-15-6-10-21(26-18-4-2-3-5-18)19(12-15)16-8-9-20-17(13-16)14-27-23-20/h6,8-10,12-14,18H,2-5,7,11H2,1H3