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

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-(3,4-dihydroxyphenyl)propan-1-one CAS Name: 3-(3,4-dihydroxyphenyl)-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-(3,4-dihydroxyphenyl)propan-1-one Traditional Name: 1-(4-benzylpiperazino)-3-(3,4-dihydroxyphenyl)propan-1-one Formula: C20H24N2O3 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCC3=CC(=C(C=C3)O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCC3=CC(=C(C=C3)O)O

InChI

InChI=1S/C20H24N2O3/c23-18-8-6-16(14-19(18)24)7-9-20(25)22-12-10-21(11-13-22)15-17-4-2-1-3-5-17/h1-6,8,14,23-24H,7,9-13,15H2