1-[4-(propan-2-yloxymethyl)phenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[4-(propan-2-yloxymethyl)phenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[4-(isopropoxymethyl)benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[oxo-[4-(propan-2-yloxymethyl)phenyl]methyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[4-(propan-2-yloxymethyl)benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[4-(isopropoxymethyl)benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1=CC=C(C=C1)C(=O)N2CCCC3=C(C=CC=C32)C(=O)O

Isomeric SMILES

CC(C)OCC1=CC=C(C=C1)C(=O)N2CCCC3=C(C=CC=C32)C(=O)O

InChI

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