2-bromanyl-5-[(3-chlorophenyl)methoxy]-3-piperazin-1-yl-pyrazine; methanoic acid

Systemtic Name: 2-bromanyl-5-[(3-chlorophenyl)methoxy]-3-piperazin-1-yl-pyrazine; methanoic acid Openeye Name: 2-bromo-5-[(3-chlorophenyl)methoxy]-3-piperazin-1-yl-pyrazine; formic acid CAS Name: 2-bromo-5-[(3-chlorophenyl)methoxy]-3-(1-piperazinyl)pyrazine; formic acid IUPAC Name: 2-bromo-5-[(3-chlorophenyl)methoxy]-3-piperazin-1-ylpyrazine; formic acid Traditional Name: 2-bromo-5-(3-chlorobenzyl)oxy-3-piperazino-pyrazine; formic acid Formula: C16H18BrClN4O3 MolecularWeight: 429.69612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC(=CN=C2Br)OCC3=CC(=CC=C3)Cl.C(=O)O

Isomeric SMILES

C1CN(CCN1)C2=NC(=CN=C2Br)OCC3=CC(=CC=C3)Cl.C(=O)O

InChI

InChI=1S/C15H16BrClN4O.CH2O2/c16-14-15(21-6-4-18-5-7-21)20-13(9-19-14)22-10-11-2-1-3-12(17)8-11;2-1-3/h1-3,8-9,18H,4-7,10H2;1H,(H,2,3)