ethyl 2-(3-aminocarbonyl-1-ethyl-4-oxidanylidene-7-pyridin-4-yl-quinolin-2-yl)ethanoate

Systemtic Name: ethyl 2-(3-aminocarbonyl-1-ethyl-4-oxidanylidene-7-pyridin-4-yl-quinolin-2-yl)ethanoate Openeye Name: ethyl 2-[3-carbamoyl-1-ethyl-4-oxo-7-(4-pyridyl)-2-quinolyl]acetate CAS Name: 2-(3-carbamoyl-1-ethyl-4-oxo-7-pyridin-4-yl-2-quinolinyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(3-carbamoyl-1-ethyl-4-oxo-7-pyridin-4-ylquinolin-2-yl)acetate Traditional Name: 2-[3-carbamoyl-1-ethyl-4-keto-7-(4-pyridyl)-2-quinolyl]acetic acid ethyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C3=CC=NC=C3)C(=O)C(=C1CC(=O)OCC)C(=O)N

Isomeric SMILES

CCN1C2=C(C=CC(=C2)C3=CC=NC=C3)C(=O)C(=C1CC(=O)OCC)C(=O)N

InChI

InChI=1S/C21H21N3O4/c1-3-24-16-11-14(13-7-9-23-10-8-13)5-6-15(16)20(26)19(21(22)27)17(24)12-18(25)28-4-2/h5-11H,3-4,12H2,1-2H3,(H2,22,27)