3-[(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)sulfanyl]propanoic acid

Systemtic Name: 3-[(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)sulfanyl]propanoic acid Openeye Name: 3-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)sulfanyl]propanoic acid CAS Name: 3-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)thio]propanoic acid IUPAC Name: 3-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)sulfanyl]propanoic acid Traditional Name: 3-[(6-chloro-2-keto-4-phenyl-1H-quinolin-3-yl)thio]propionic acid Formula: C18H14ClNO3S MolecularWeight: 359.82666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)Cl)SCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)Cl)SCCC(=O)O

InChI

InChI=1S/C18H14ClNO3S/c19-12-6-7-14-13(10-12)16(11-4-2-1-3-5-11)17(18(23)20-14)24-9-8-15(21)22/h1-7,10H,8-9H2,(H,20,23)(H,21,22)