2-ethyl-3-phenyl-3-(quinolin-6-ylcarbonylamino)butanoic acid

Systemtic Name: 2-ethyl-3-phenyl-3-(quinolin-6-ylcarbonylamino)butanoic acid Openeye Name: 2-ethyl-3-phenyl-3-(quinoline-6-carbonylamino)butanoic acid CAS Name: 2-ethyl-3-[[oxo(6-quinolinyl)methyl]amino]-3-phenylbutanoic acid IUPAC Name: 2-ethyl-3-phenyl-3-(quinoline-6-carbonylamino)butanoic acid Traditional Name: 2-ethyl-3-phenyl-3-(quinoline-6-carbonylamino)butyric acid Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)C(C)(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)N=CC=C3

Isomeric SMILES

CCC(C(=O)O)C(C)(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)N=CC=C3

InChI

InChI=1S/C22H22N2O3/c1-3-18(21(26)27)22(2,17-9-5-4-6-10-17)24-20(25)16-11-12-19-15(14-16)8-7-13-23-19/h4-14,18H,3H2,1-2H3,(H,24,25)(H,26,27)