2-[[3-[1-(azepan-1-yl)-1-phenyl-propyl]quinolin-2-yl]carbonylamino]oxy-2-oxidanylidene-ethanoate

Systemtic Name: 2-[[3-[1-(azepan-1-yl)-1-phenyl-propyl]quinolin-2-yl]carbonylamino]oxy-2-oxidanylidene-ethanoate Openeye Name: 2-[[3-[1-(azepan-1-yl)-1-phenyl-propyl]quinoline-2-carbonyl]amino]oxy-2-oxo-acetate CAS Name: 2-[[[3-[1-(1-azepanyl)-1-phenylpropyl]-2-quinolinyl]-oxomethyl]amino]oxy-2-oxoacetate IUPAC Name: 2-[[3-[1-(azepan-1-yl)-1-phenylpropyl]quinoline-2-carbonyl]amino]oxy-2-oxoacetate Traditional Name: 2-[[3-[1-(azepan-1-yl)-1-phenyl-propyl]quinoline-2-carbonyl]amino]oxy-2-keto-acetate Formula: C27H28N3O5- MolecularWeight: 474.52832

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)(C2=CC3=CC=CC=C3N=C2C(=O)NOC(=O)C(=O)[O-])N4CCCCCC4

Isomeric SMILES

CCC(C1=CC=CC=C1)(C2=CC3=CC=CC=C3N=C2C(=O)NOC(=O)C(=O)[O-])N4CCCCCC4

InChI

InChI=1S/C27H29N3O5/c1-2-27(20-13-6-5-7-14-20,30-16-10-3-4-11-17-30)21-18-19-12-8-9-15-22(19)28-23(21)24(31)29-35-26(34)25(32)33/h5-9,12-15,18H,2-4,10-11,16-17H2,1H3,(H,29,31)(H,32,33)/p-1