ethyl 6,7-bis(chloranyl)-3-(4-morpholin-4-ylcarbonyl-1,4-diazepan-1-yl)quinoxaline-2-carboxylate

Systemtic Name: ethyl 6,7-bis(chloranyl)-3-(4-morpholin-4-ylcarbonyl-1,4-diazepan-1-yl)quinoxaline-2-carboxylate Openeye Name: ethyl 6,7-dichloro-3-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate CAS Name: 6,7-dichloro-3-[4-[4-morpholinyl(oxo)methyl]-1,4-diazepan-1-yl]-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7-dichloro-3-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate Traditional Name: 6,7-dichloro-3-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylic acid ethyl ester Formula: C21H25Cl2N5O4 MolecularWeight: 482.3603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=CC(=C(C=C2N=C1N3CCCN(CC3)C(=O)N4CCOCC4)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=NC2=CC(=C(C=C2N=C1N3CCCN(CC3)C(=O)N4CCOCC4)Cl)Cl

InChI

InChI=1S/C21H25Cl2N5O4/c1-2-32-20(29)18-19(25-17-13-15(23)14(22)12-16(17)24-18)26-4-3-5-27(7-6-26)21(30)28-8-10-31-11-9-28/h12-13H,2-11H2,1H3