5-ethoxy-3-(4-nitrophenyl)-5-oxidanylidene-2-(quinolin-2-ylcarbonylamino)pentanoic acid

Systemtic Name: 5-ethoxy-3-(4-nitrophenyl)-5-oxidanylidene-2-(quinolin-2-ylcarbonylamino)pentanoic acid Openeye Name: 5-ethoxy-3-(4-nitrophenyl)-5-oxo-2-(quinoline-2-carbonylamino)pentanoic acid CAS Name: 5-ethoxy-3-(4-nitrophenyl)-5-oxo-2-[[oxo(2-quinolinyl)methyl]amino]pentanoic acid IUPAC Name: 5-ethoxy-3-(4-nitrophenyl)-5-oxo-2-(quinoline-2-carbonylamino)pentanoic acid Traditional Name: 5-ethoxy-5-keto-3-(4-nitrophenyl)-2-(quinaldoylamino)valeric acid Formula: C23H21N3O7 MolecularWeight: 451.42874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=C(C=C1)[N+](=O)[O-])C(C(=O)O)NC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)CC(C1=CC=C(C=C1)[N+](=O)[O-])C(C(=O)O)NC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H21N3O7/c1-2-33-20(27)13-17(14-7-10-16(11-8-14)26(31)32)21(23(29)30)25-22(28)19-12-9-15-5-3-4-6-18(15)24-19/h3-12,17,21H,2,13H2,1H3,(H,25,28)(H,29,30)