methyl 2-[3-(7-chloranylquinolin-2-yl)sulfanylphenoxy]propanoate

Systemtic Name: methyl 2-[3-(7-chloranylquinolin-2-yl)sulfanylphenoxy]propanoate Openeye Name: methyl 2-[3-[(7-chloro-2-quinolyl)sulfanyl]phenoxy]propanoate CAS Name: 2-[3-[(7-chloro-2-quinolinyl)thio]phenoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[3-(7-chloroquinolin-2-yl)sulfanylphenoxy]propanoate Traditional Name: 2-[3-[(7-chloro-2-quinolyl)thio]phenoxy]propionic acid methyl ester Formula: C19H16ClNO3S MolecularWeight: 373.85324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC1=CC(=CC=C1)SC2=NC3=C(C=CC(=C3)Cl)C=C2

Isomeric SMILES

CC(C(=O)OC)OC1=CC(=CC=C1)SC2=NC3=C(C=CC(=C3)Cl)C=C2

InChI

InChI=1S/C19H16ClNO3S/c1-12(19(22)23-2)24-15-4-3-5-16(11-15)25-18-9-7-13-6-8-14(20)10-17(13)21-18/h3-12H,1-2H3