ethyl 2-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-1,8-bis(oxidanylidene)-4,8a-dihydro-3H-pyrrolo[1,2-a]pyrazine-7-carboxylate

Systemtic Name: ethyl 2-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-1,8-bis(oxidanylidene)-4,8a-dihydro-3H-pyrrolo[1,2-a]pyrazine-7-carboxylate Openeye Name: ethyl 2-[(3-chloro-4-fluoro-phenyl)methyl]-1,8-dioxo-4,8a-dihydro-3H-pyrrolo[1,2-a]pyrazine-7-carboxylate CAS Name: 2-[(3-chloro-4-fluorophenyl)methyl]-1,8-dioxo-4,8a-dihydro-3H-pyrrolo[1,2-a]pyrazine-7-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-chloro-4-fluorophenyl)methyl]-1,8-dioxo-4,8a-dihydro-3H-pyrrolo[1,2-a]pyrazine-7-carboxylate Traditional Name: 2-(3-chloro-4-fluoro-benzyl)-1,8-diketo-4,8a-dihydro-3H-pyrrolo[1,2-a]pyrazine-7-carboxylic acid ethyl ester Formula: C17H16ClFN2O4 MolecularWeight: 366.771343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN2CCN(C(=O)C2C1=O)CC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CCOC(=O)C1=CN2CCN(C(=O)C2C1=O)CC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H16ClFN2O4/c1-2-25-17(24)11-9-20-5-6-21(16(23)14(20)15(11)22)8-10-3-4-13(19)12(18)7-10/h3-4,7,9,14H,2,5-6,8H2,1H3