5-[4-[4-(diphenylmethyl)piperazin-1-yl]butyl]-3-phenyl-1,2-oxazole hydrochloride

Systemtic Name: 5-[4-[4-(diphenylmethyl)piperazin-1-yl]butyl]-3-phenyl-1,2-oxazole hydrochloride Openeye Name: 5-[4-(4-benzhydrylpiperazin-1-yl)butyl]-3-phenyl-isoxazole hydrochloride CAS Name: 5-[4-[4-(diphenylmethyl)-1-piperazinyl]butyl]-3-phenylisoxazole hydrochloride IUPAC Name: 5-[4-(4-benzhydrylpiperazin-1-yl)butyl]-3-phenyl-1,2-oxazole hydrochloride Traditional Name: 5-[4-(4-benzhydrylpiperazino)butyl]-3-phenyl-isoxazole hydrochloride Formula: C30H34ClN3O MolecularWeight: 488.06346

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CC(=NO2)C3=CC=CC=C3)C(C4=CC=CC=C4)C5=CC=CC=C5.Cl

Isomeric SMILES

C1CN(CCN1CCCCC2=CC(=NO2)C3=CC=CC=C3)C(C4=CC=CC=C4)C5=CC=CC=C5.Cl

InChI

InChI=1S/C30H33N3O.ClH/c1-4-12-25(13-5-1)29-24-28(34-31-29)18-10-11-19-32-20-22-33(23-21-32)30(26-14-6-2-7-15-26)27-16-8-3-9-17-27;/h1-9,12-17,24,30H,10-11,18-23H2;1H