methyl 2-methyl-2-[8-(2-phenyl-1,3-thiazol-4-yl)octoxy]propanoate

Systemtic Name: methyl 2-methyl-2-[8-(2-phenyl-1,3-thiazol-4-yl)octoxy]propanoate Openeye Name: methyl 2-methyl-2-[8-(2-phenylthiazol-4-yl)octoxy]propanoate CAS Name: 2-methyl-2-[8-(2-phenyl-4-thiazolyl)octoxy]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[8-(2-phenyl-1,3-thiazol-4-yl)octoxy]propanoate Traditional Name: 2-methyl-2-[8-(2-phenylthiazol-4-yl)octoxy]propionic acid methyl ester Formula: C22H31NO3S MolecularWeight: 389.55144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)OCCCCCCCCC1=CSC(=N1)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C(=O)OC)OCCCCCCCCC1=CSC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C22H31NO3S/c1-22(2,21(24)25-3)26-16-12-7-5-4-6-11-15-19-17-27-20(23-19)18-13-9-8-10-14-18/h8-10,13-14,17H,4-7,11-12,15-16H2,1-3H3