(7-quinolin-2-ylheptanoylamino) 4-fluoranylbenzoate

Systemtic Name: (7-quinolin-2-ylheptanoylamino) 4-fluoranylbenzoate Openeye Name: [7-(2-quinolyl)heptanoylamino] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [[1-oxo-7-(2-quinolinyl)heptyl]amino] ester IUPAC Name: (7-quinolin-2-ylheptanoylamino) 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [7-(2-quinolyl)heptanoylamino] ester Formula: C23H23FN2O3 MolecularWeight: 394.438723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)CCCCCCC(=O)NOC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)CCCCCCC(=O)NOC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H23FN2O3/c24-19-14-11-18(12-15-19)23(28)29-26-22(27)10-4-2-1-3-8-20-16-13-17-7-5-6-9-21(17)25-20/h5-7,9,11-16H,1-4,8,10H2,(H,26,27)