(3-bromanyl-4-butoxy-phenyl)-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3-bromanyl-4-butoxy-phenyl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-(3-bromo-4-butoxy-phenyl)methanone CAS Name: (3-bromo-4-butoxyphenyl)-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(3-bromo-4-butoxyphenyl)methanone Traditional Name: (4-benzylpiperazino)-(3-bromo-4-butoxy-phenyl)methanone Formula: C22H27BrN2O2 MolecularWeight: 431.36598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)Br

InChI

InChI=1S/C22H27BrN2O2/c1-2-3-15-27-21-10-9-19(16-20(21)23)22(26)25-13-11-24(12-14-25)17-18-7-5-4-6-8-18/h4-10,16H,2-3,11-15,17H2,1H3