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

Systemtic Name: ethyl 6,7-bis(chloranyl)-3-(4-cyclohexylcarbonyl-1,4-diazepan-1-yl)quinoxaline-2-carboxylate Openeye Name: ethyl 6,7-dichloro-3-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate CAS Name: 6,7-dichloro-3-[4-[cyclohexyl(oxo)methyl]-1,4-diazepan-1-yl]-2-quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7-dichloro-3-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate Traditional Name: 6,7-dichloro-3-[4-(cyclohexanecarbonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylic acid ethyl ester Formula: C23H28Cl2N4O3 MolecularWeight: 479.39942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=CC(=C(C=C2N=C1N3CCCN(CC3)C(=O)C4CCCCC4)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=NC2=CC(=C(C=C2N=C1N3CCCN(CC3)C(=O)C4CCCCC4)Cl)Cl

InChI

InChI=1S/C23H28Cl2N4O3/c1-2-32-23(31)20-21(27-19-14-17(25)16(24)13-18(19)26-20)28-9-6-10-29(12-11-28)22(30)15-7-4-3-5-8-15/h13-15H,2-12H2,1H3