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

Systemtic Name: 1-[2-(2,3-dimethylphenoxy)ethanoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[2-(2,3-dimethylphenoxy)acetyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[2-(2,3-dimethylphenoxy)-1-oxoethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[2-(2,3-dimethylphenoxy)acetyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[2-(2,3-dimethylphenoxy)acetyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO4/c1-13-6-3-10-18(14(13)2)25-12-19(22)21-11-5-8-15-16(20(23)24)7-4-9-17(15)21/h3-4,6-7,9-10H,5,8,11-12H2,1-2H3,(H,23,24)