3-(1,3-benzodioxol-5-ylmethylamino)-1-[(4-chlorophenyl)methyl]pyrazin-2-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylamino)-1-[(4-chlorophenyl)methyl]pyrazin-2-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethylamino)-1-[(4-chlorophenyl)methyl]pyrazin-2-one CAS Name: 3-(1,3-benzodioxol-5-ylmethylamino)-1-[(4-chlorophenyl)methyl]-2-pyrazinone IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylamino)-1-[(4-chlorophenyl)methyl]pyrazin-2-one Traditional Name: 1-(4-chlorobenzyl)-3-(piperonylamino)pyrazin-2-one Formula: C19H16ClN3O3 MolecularWeight: 369.80164

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC=CN(C3=O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC=CN(C3=O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H16ClN3O3/c20-15-4-1-13(2-5-15)11-23-8-7-21-18(19(23)24)22-10-14-3-6-16-17(9-14)26-12-25-16/h1-9H,10-12H2,(H,21,22)