3-[3,4-bis(oxidanyl)phenyl]-1-[4-(diphenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]-1-[4-(diphenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(3,4-dihydroxyphenyl)propan-1-one CAS Name: 3-(3,4-dihydroxyphenyl)-1-[4-(diphenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(3,4-dihydroxyphenyl)propan-1-one Traditional Name: 1-(4-benzhydrylpiperazino)-3-(3,4-dihydroxyphenyl)propan-1-one Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCC4=CC(=C(C=C4)O)O

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCC4=CC(=C(C=C4)O)O

InChI

InChI=1S/C26H28N2O3/c29-23-13-11-20(19-24(23)30)12-14-25(31)27-15-17-28(18-16-27)26(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-11,13,19,26,29-30H,12,14-18H2