ethyl 3-(7-bromanyl-8-phenylmethoxy-quinolin-2-yl)-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-(7-bromanyl-8-phenylmethoxy-quinolin-2-yl)-3-oxidanylidene-propanoate Openeye Name: ethyl 3-(8-benzyloxy-7-bromo-2-quinolyl)-3-oxo-propanoate CAS Name: 3-(7-bromo-8-phenylmethoxy-2-quinolinyl)-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-(7-bromo-8-phenylmethoxyquinolin-2-yl)-3-oxopropanoate Traditional Name: 3-(8-benzoxy-7-bromo-2-quinolyl)-3-keto-propionic acid ethyl ester Formula: C21H18BrNO4 MolecularWeight: 428.27592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)C1=NC2=C(C=CC(=C2OCC3=CC=CC=C3)Br)C=C1

Isomeric SMILES

CCOC(=O)CC(=O)C1=NC2=C(C=CC(=C2OCC3=CC=CC=C3)Br)C=C1

InChI

InChI=1S/C21H18BrNO4/c1-2-26-19(25)12-18(24)17-11-9-15-8-10-16(22)21(20(15)23-17)27-13-14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3