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

Systemtic Name: 1-[2-(3,4,5-trimethoxyphenyl)ethanoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[2-(3,4,5-trimethoxyphenyl)acetyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[1-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[2-(3,4,5-trimethoxyphenyl)acetyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[2-(3,4,5-trimethoxyphenyl)acetyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(=O)N2CCCC3=C(C=CC=C32)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC(=O)N2CCCC3=C(C=CC=C32)C(=O)O

InChI

InChI=1S/C21H23NO6/c1-26-17-10-13(11-18(27-2)20(17)28-3)12-19(23)22-9-5-7-14-15(21(24)25)6-4-8-16(14)22/h4,6,8,10-11H,5,7,9,12H2,1-3H3,(H,24,25)