methyl 3-(3-hexoxypyrazin-2-yl)-3-oxidanyl-azepane-1-carboxylate

Systemtic Name: methyl 3-(3-hexoxypyrazin-2-yl)-3-oxidanyl-azepane-1-carboxylate Openeye Name: methyl 3-(3-hexoxypyrazin-2-yl)-3-hydroxy-azepane-1-carboxylate CAS Name: 3-(3-hexoxy-2-pyrazinyl)-3-hydroxy-1-azepanecarboxylic acid methyl ester IUPAC Name: methyl 3-(3-hexoxypyrazin-2-yl)-3-hydroxyazepane-1-carboxylate Traditional Name: 3-(3-hexoxypyrazin-2-yl)-3-hydroxy-azepane-1-carboxylic acid methyl ester Formula: C18H29N3O4 MolecularWeight: 351.44056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=NC=CN=C1C2(CCCCN(C2)C(=O)OC)O

Isomeric SMILES

CCCCCCOC1=NC=CN=C1C2(CCCCN(C2)C(=O)OC)O

InChI

InChI=1S/C18H29N3O4/c1-3-4-5-8-13-25-16-15(19-10-11-20-16)18(23)9-6-7-12-21(14-18)17(22)24-2/h10-11,23H,3-9,12-14H2,1-2H3