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

Systemtic Name: (3-bromanyl-4-butoxy-phenyl)-[4-(diphenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-(3-bromo-4-butoxy-phenyl)methanone CAS Name: (3-bromo-4-butoxyphenyl)-[4-(diphenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-(3-bromo-4-butoxyphenyl)methanone Traditional Name: (4-benzhydrylpiperazino)-(3-bromo-4-butoxy-phenyl)methanone Formula: C28H31BrN2O2 MolecularWeight: 507.46194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C28H31BrN2O2/c1-2-3-20-33-26-15-14-24(21-25(26)29)28(32)31-18-16-30(17-19-31)27(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-15,21,27H,2-3,16-20H2,1H3