quinolin-8-ylmethyl 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: quinolin-8-ylmethyl 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: 8-quinolylmethyl 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid 8-quinolylmethyl ester Formula: C20H16N2O2S MolecularWeight: 348.41824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCC(=O)OCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCC(=O)OCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C20H16N2O2S/c23-19(11-10-18-22-16-8-1-2-9-17(16)25-18)24-13-15-6-3-5-14-7-4-12-21-20(14)15/h1-9,12H,10-11,13H2