N-(4-bromanyl-2-methoxy-phenyl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-methoxy-phenyl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-(4-bromo-2-methoxy-phenyl)acetamide CAS Name: N-(4-bromo-2-methoxyphenyl)-2-[4-(phenylmethyl)-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-(4-bromo-2-methoxyphenyl)acetamide Traditional Name: 2-(4-benzylpiperazino)-N-(4-bromo-2-methoxy-phenyl)acetamide Formula: C20H24BrN3O2 MolecularWeight: 418.32746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)Br)NC(=O)CN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)Br)NC(=O)CN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24BrN3O2/c1-26-19-13-17(21)7-8-18(19)22-20(25)15-24-11-9-23(10-12-24)14-16-5-3-2-4-6-16/h2-8,13H,9-12,14-15H2,1H3,(H,22,25)