2-[6-[2-(butanoylamino)propanoyloxymethyl]quinolin-2-yl]benzoic acid

Systemtic Name: 2-[6-[2-(butanoylamino)propanoyloxymethyl]quinolin-2-yl]benzoic acid Openeye Name: 2-[6-[2-(butanoylamino)propanoyloxymethyl]-2-quinolyl]benzoic acid CAS Name: 2-[6-[[1-oxo-2-(1-oxobutylamino)propoxy]methyl]-2-quinolinyl]benzoic acid IUPAC Name: 2-[6-[2-(butanoylamino)propanoyloxymethyl]quinolin-2-yl]benzoic acid Traditional Name: 2-[6-(2-butyramidopropanoyloxymethyl)-2-quinolyl]benzoic acid Formula: C24H24N2O5 MolecularWeight: 420.45776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(C)C(=O)OCC1=CC2=C(C=C1)N=C(C=C2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CCCC(=O)NC(C)C(=O)OCC1=CC2=C(C=C1)N=C(C=C2)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C24H24N2O5/c1-3-6-22(27)25-15(2)24(30)31-14-16-9-11-20-17(13-16)10-12-21(26-20)18-7-4-5-8-19(18)23(28)29/h4-5,7-13,15H,3,6,14H2,1-2H3,(H,25,27)(H,28,29)