(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-azanylpyrazine-2-carboxylate

Systemtic Name: (6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-azanylpyrazine-2-carboxylate Openeye Name: (6-chloro-7-ethyl-2-oxo-chromen-4-yl)methyl 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid (6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-ethyl-2-oxochromen-4-yl)methyl 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid (6-chloro-7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C17H14ClN3O4 MolecularWeight: 359.76376

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=NC=CN=C3N)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=NC=CN=C3N)Cl

InChI

InChI=1S/C17H14ClN3O4/c1-2-9-5-13-11(7-12(9)18)10(6-14(22)25-13)8-24-17(23)15-16(19)21-4-3-20-15/h3-7H,2,8H2,1H3,(H2,19,21)