ethyl 6-bromanyl-4-[[2-(dipropylamino)-2-oxidanylidene-ethyl]amino]quinoline-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-4-[[2-(dipropylamino)-2-oxidanylidene-ethyl]amino]quinoline-3-carboxylate Openeye Name: ethyl 6-bromo-4-[[2-(dipropylamino)-2-oxo-ethyl]amino]quinoline-3-carboxylate CAS Name: 6-bromo-4-[[2-(dipropylamino)-2-oxoethyl]amino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-4-[[2-(dipropylamino)-2-oxoethyl]amino]quinoline-3-carboxylate Traditional Name: 6-bromo-4-[[2-(dipropylamino)-2-keto-ethyl]amino]quinoline-3-carboxylic acid ethyl ester Formula: C20H26BrN3O3 MolecularWeight: 436.34274

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CNC1=C2C=C(C=CC2=NC=C1C(=O)OCC)Br

Isomeric SMILES

CCCN(CCC)C(=O)CNC1=C2C=C(C=CC2=NC=C1C(=O)OCC)Br

InChI

InChI=1S/C20H26BrN3O3/c1-4-9-24(10-5-2)18(25)13-23-19-15-11-14(21)7-8-17(15)22-12-16(19)20(26)27-6-3/h7-8,11-12H,4-6,9-10,13H2,1-3H3,(H,22,23)