methyl 3-azanylidene-5-(2-methylpropyl)-4-oxidanyl-6-phenylmethoxy-pyrazine-2-carboxylate

Systemtic Name: methyl 3-azanylidene-5-(2-methylpropyl)-4-oxidanyl-6-phenylmethoxy-pyrazine-2-carboxylate Openeye Name: methyl 6-benzyloxy-4-hydroxy-3-imino-5-isobutyl-pyrazine-2-carboxylate CAS Name: 4-hydroxy-3-imino-5-(2-methylpropyl)-6-phenylmethoxy-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 4-hydroxy-3-imino-5-(2-methylpropyl)-6-phenylmethoxypyrazine-2-carboxylate Traditional Name: 6-benzoxy-4-hydroxy-3-imino-5-isobutyl-pyrazinic acid methyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(N=C(C(=N)N1O)C(=O)OC)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC1=C(N=C(C(=N)N1O)C(=O)OC)OCC2=CC=CC=C2

InChI

InChI=1S/C17H21N3O4/c1-11(2)9-13-16(24-10-12-7-5-4-6-8-12)19-14(17(21)23-3)15(18)20(13)22/h4-8,11,18,22H,9-10H2,1-3H3