4-oxidanylidene-8-[[4-(4-phenylbutoxy)phenyl]carbonylamino]-1H-quinoline-2-carboxylic acid

Systemtic Name: 4-oxidanylidene-8-[[4-(4-phenylbutoxy)phenyl]carbonylamino]-1H-quinoline-2-carboxylic acid Openeye Name: 4-oxo-8-[[4-(4-phenylbutoxy)benzoyl]amino]-1H-quinoline-2-carboxylic acid CAS Name: 4-oxo-8-[[oxo-[4-(4-phenylbutoxy)phenyl]methyl]amino]-1H-quinoline-2-carboxylic acid IUPAC Name: 4-oxo-8-[[4-(4-phenylbutoxy)benzoyl]amino]-1H-quinoline-2-carboxylic acid Traditional Name: 4-keto-8-[[4-(4-phenylbutoxy)benzoyl]amino]-1H-quinoline-2-carboxylic acid Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOC2=CC=C(C=C2)C(=O)NC3=CC=CC4=C3NC(=CC4=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCOC2=CC=C(C=C2)C(=O)NC3=CC=CC4=C3NC(=CC4=O)C(=O)O

InChI

InChI=1S/C27H24N2O5/c30-24-17-23(27(32)33)28-25-21(24)10-6-11-22(25)29-26(31)19-12-14-20(15-13-19)34-16-5-4-9-18-7-2-1-3-8-18/h1-3,6-8,10-15,17H,4-5,9,16H2,(H,28,30)(H,29,31)(H,32,33)