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

Systemtic Name: (3-bromanyl-4-hexoxy-phenyl)-[4-(diphenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-(3-bromo-4-hexoxy-phenyl)methanone CAS Name: (3-bromo-4-hexoxyphenyl)-[4-(diphenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-(3-bromo-4-hexoxyphenyl)methanone Traditional Name: (4-benzhydrylpiperazino)-(3-bromo-4-hexoxy-phenyl)methanone Formula: C30H35BrN2O2 MolecularWeight: 535.5151

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C30H35BrN2O2/c1-2-3-4-11-22-35-28-17-16-26(23-27(28)31)30(34)33-20-18-32(19-21-33)29(24-12-7-5-8-13-24)25-14-9-6-10-15-25/h5-10,12-17,23,29H,2-4,11,18-22H2,1H3