ethyl 3-bromanyl-2-(3-methoxy-3-oxidanylidene-propyl)-2H-quinoline-1-carboxylate

Systemtic Name: ethyl 3-bromanyl-2-(3-methoxy-3-oxidanylidene-propyl)-2H-quinoline-1-carboxylate Openeye Name: ethyl 3-bromo-2-(3-methoxy-3-oxo-propyl)-2H-quinoline-1-carboxylate CAS Name: 3-bromo-2-(3-methoxy-3-oxopropyl)-2H-quinoline-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-bromo-2-(3-methoxy-3-oxopropyl)-2H-quinoline-1-carboxylate Traditional Name: 3-bromo-2-(3-keto-3-methoxy-propyl)-2H-quinoline-1-carboxylic acid ethyl ester Formula: C16H18BrNO4 MolecularWeight: 368.22242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C(=CC2=CC=CC=C21)Br)CCC(=O)OC

Isomeric SMILES

CCOC(=O)N1C(C(=CC2=CC=CC=C21)Br)CCC(=O)OC

InChI

InChI=1S/C16H18BrNO4/c1-3-22-16(20)18-13-7-5-4-6-11(13)10-12(17)14(18)8-9-15(19)21-2/h4-7,10,14H,3,8-9H2,1-2H3