ethyl 6-butoxy-4-[[2-(diethylamino)-2-oxidanylidene-ethyl]amino]quinoline-3-carboxylate

Systemtic Name: ethyl 6-butoxy-4-[[2-(diethylamino)-2-oxidanylidene-ethyl]amino]quinoline-3-carboxylate Openeye Name: ethyl 6-butoxy-4-[[2-(diethylamino)-2-oxo-ethyl]amino]quinoline-3-carboxylate CAS Name: 6-butoxy-4-[[2-(diethylamino)-2-oxoethyl]amino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-butoxy-4-[[2-(diethylamino)-2-oxoethyl]amino]quinoline-3-carboxylate Traditional Name: 6-butoxy-4-[[2-(diethylamino)-2-keto-ethyl]amino]quinoline-3-carboxylic acid ethyl ester Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NCC(=O)N(CC)CC

Isomeric SMILES

CCCCOC1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)NCC(=O)N(CC)CC

InChI

InChI=1S/C22H31N3O4/c1-5-9-12-29-16-10-11-19-17(13-16)21(18(14-23-19)22(27)28-8-4)24-15-20(26)25(6-2)7-3/h10-11,13-14H,5-9,12,15H2,1-4H3,(H,23,24)