4-oxidanylidene-6-(5-phenoxypentoxy)-1H-quinoline-3-carboxylic acid

Systemtic Name: 4-oxidanylidene-6-(5-phenoxypentoxy)-1H-quinoline-3-carboxylic acid Openeye Name: 4-oxo-6-(5-phenoxypentoxy)-1H-quinoline-3-carboxylic acid CAS Name: 4-oxo-6-(5-phenoxypentoxy)-1H-quinoline-3-carboxylic acid IUPAC Name: 4-oxo-6-(5-phenoxypentoxy)-1H-quinoline-3-carboxylic acid Traditional Name: 4-keto-6-(5-phenoxypentoxy)-1H-quinoline-3-carboxylic acid Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCCCOC2=CC3=C(C=C2)NC=C(C3=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OCCCCCOC2=CC3=C(C=C2)NC=C(C3=O)C(=O)O

InChI

InChI=1S/C21H21NO5/c23-20-17-13-16(9-10-19(17)22-14-18(20)21(24)25)27-12-6-2-5-11-26-15-7-3-1-4-8-15/h1,3-4,7-10,13-14H,2,5-6,11-12H2,(H,22,23)(H,24,25)