ethyl 4-[2-[[4-(2-azanyl-2-oxidanylidene-ethoxy)quinolin-2-yl]carbonylamino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[[4-(2-azanyl-2-oxidanylidene-ethoxy)quinolin-2-yl]carbonylamino]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[[4-(2-amino-2-oxo-ethoxy)quinoline-2-carbonyl]amino]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[[[4-(2-amino-2-oxoethoxy)-2-quinolinyl]-oxomethyl]amino]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[[4-(2-amino-2-oxoethoxy)quinoline-2-carbonyl]amino]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[4-(2-amino-2-keto-ethoxy)quinoline-2-carbonyl]amino]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H25N5O6 MolecularWeight: 443.4531

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)C2=NC3=CC=CC=C3C(=C2)OCC(=O)N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)C2=NC3=CC=CC=C3C(=C2)OCC(=O)N

InChI

InChI=1S/C21H25N5O6/c1-2-31-21(30)26-9-7-25(8-10-26)19(28)12-23-20(29)16-11-17(32-13-18(22)27)14-5-3-4-6-15(14)24-16/h3-6,11H,2,7-10,12-13H2,1H3,(H2,22,27)(H,23,29)