3-[(3S)-5,7-dimethyl-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]propanoic acid

Systemtic Name: 3-[(3S)-5,7-dimethyl-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]propanoic acid Openeye Name: 3-[(3S)-5,7-dimethyl-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanoic acid CAS Name: 3-[(3S)-5,7-dimethyl-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanoic acid IUPAC Name: 3-[(3S)-5,7-dimethyl-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanoic acid Traditional Name: 3-[(3S)-2-keto-5,7-dimethyl-3,4-dihydro-1H-quinolin-3-yl]propionic acid Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2CC(C(=O)NC2=C1)CCC(=O)O)C

Isomeric SMILES

CC1=CC(=C2C[C@@H](C(=O)NC2=C1)CCC(=O)O)C

InChI

InChI=1S/C14H17NO3/c1-8-5-9(2)11-7-10(3-4-13(16)17)14(18)15-12(11)6-8/h5-6,10H,3-4,7H2,1-2H3,(H,15,18)(H,16,17)/t10-/m0/s1