(5-bromanyl-2-phenethyloxy-phenyl)-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (5-bromanyl-2-phenethyloxy-phenyl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-(5-bromo-2-phenethyloxy-phenyl)methanone CAS Name: (5-bromo-2-phenethyloxyphenyl)-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(5-bromo-2-phenethyloxyphenyl)methanone Traditional Name: (4-benzylpiperazino)-(5-bromo-2-phenethyloxy-phenyl)methanone Formula: C26H27BrN2O2 MolecularWeight: 479.40878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)Br)OCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)Br)OCCC4=CC=CC=C4

InChI

InChI=1S/C26H27BrN2O2/c27-23-11-12-25(31-18-13-21-7-3-1-4-8-21)24(19-23)26(30)29-16-14-28(15-17-29)20-22-9-5-2-6-10-22/h1-12,19H,13-18,20H2