1-[3-(2,5-dimethylphenoxy)propanoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[3-(2,5-dimethylphenoxy)propanoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[3-(2,5-dimethylphenoxy)propanoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[3-(2,5-dimethylphenoxy)-1-oxopropyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[3-(2,5-dimethylphenoxy)propanoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[3-(2,5-dimethylphenoxy)propanoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCC(=O)N2CCCC3=C(C=CC=C32)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCC(=O)N2CCCC3=C(C=CC=C32)C(=O)O

InChI

InChI=1S/C21H23NO4/c1-14-8-9-15(2)19(13-14)26-12-10-20(23)22-11-4-6-16-17(21(24)25)5-3-7-18(16)22/h3,5,7-9,13H,4,6,10-12H2,1-2H3,(H,24,25)