3-[(3S)-8-chloranyl-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]propanoic acid

Systemtic Name: 3-[(3S)-8-chloranyl-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]propanoic acid Openeye Name: 3-[(3S)-8-chloro-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanoic acid CAS Name: 3-[(3S)-8-chloro-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanoic acid IUPAC Name: 3-[(3S)-8-chloro-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanoic acid Traditional Name: 3-[(3S)-8-chloro-2-keto-3,4-dihydro-1H-quinolin-3-yl]propionic acid Formula: C12H12ClNO3 MolecularWeight: 253.68158

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NC2=C1C=CC=C2Cl)CCC(=O)O

Isomeric SMILES

C1[C@@H](C(=O)NC2=C1C=CC=C2Cl)CCC(=O)O

InChI

InChI=1S/C12H12ClNO3/c13-9-3-1-2-7-6-8(4-5-10(15)16)12(17)14-11(7)9/h1-3,8H,4-6H2,(H,14,17)(H,15,16)/t8-/m0/s1