ethyl 4-[6-chloranyl-4-[(4-methoxyphenyl)methyl]-3-oxidanylidene-pyrazin-2-yl]benzoate

Systemtic Name: ethyl 4-[6-chloranyl-4-[(4-methoxyphenyl)methyl]-3-oxidanylidene-pyrazin-2-yl]benzoate Openeye Name: ethyl 4-[6-chloro-4-[(4-methoxyphenyl)methyl]-3-oxo-pyrazin-2-yl]benzoate CAS Name: 4-[6-chloro-4-[(4-methoxyphenyl)methyl]-3-oxo-2-pyrazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[6-chloro-4-[(4-methoxyphenyl)methyl]-3-oxopyrazin-2-yl]benzoate Traditional Name: 4-(6-chloro-3-keto-4-p-anisyl-pyrazin-2-yl)benzoic acid ethyl ester Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=NC(=CN(C2=O)CC3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=NC(=CN(C2=O)CC3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C21H19ClN2O4/c1-3-28-21(26)16-8-6-15(7-9-16)19-20(25)24(13-18(22)23-19)12-14-4-10-17(27-2)11-5-14/h4-11,13H,3,12H2,1-2H3