methyl 2-[(3-azanylpyrazin-2-yl)carbonyloxymethyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[(3-azanylpyrazin-2-yl)carbonyloxymethyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-[(3-aminopyrazine-2-carbonyl)oxymethyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[[(3-amino-2-pyrazinyl)-oxomethoxy]methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-aminopyrazine-2-carbonyl)oxymethyl]-4-phenylquinoline-3-carboxylate Traditional Name: 2-[(3-aminopyrazinoyl)oxymethyl]-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C23H18N4O4 MolecularWeight: 414.41342

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=NC=CN=C3N)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=NC=CN=C3N)C4=CC=CC=C4

InChI

InChI=1S/C23H18N4O4/c1-30-22(28)19-17(13-31-23(29)20-21(24)26-12-11-25-20)27-16-10-6-5-9-15(16)18(19)14-7-3-2-4-8-14/h2-12H,13H2,1H3,(H2,24,26)