ethyl 4-[2-chloranyl-6-(quinoxalin-2-ylcarbonylamino)phenyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-chloranyl-6-(quinoxalin-2-ylcarbonylamino)phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-chloro-6-(quinoxaline-2-carbonylamino)phenyl]piperazine-1-carboxylate CAS Name: 4-[2-chloro-6-[[oxo(2-quinoxalinyl)methyl]amino]phenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-chloro-6-(quinoxaline-2-carbonylamino)phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-chloro-6-(quinoxaline-2-carbonylamino)phenyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H22ClN5O3 MolecularWeight: 439.89478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=NC4=CC=CC=C4N=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C22H22ClN5O3/c1-2-31-22(30)28-12-10-27(11-13-28)20-15(23)6-5-9-18(20)26-21(29)19-14-24-16-7-3-4-8-17(16)25-19/h3-9,14H,2,10-13H2,1H3,(H,26,29)