(E)-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-(2-methoxyphenyl)-2-phenyl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-(2-methoxyphenyl)-2-phenyl-prop-2-en-1-one Openeye Name: (E)-1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-(2-methoxyphenyl)-2-phenyl-prop-2-en-1-one CAS Name: (E)-1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-3-(2-methoxyphenyl)-2-phenyl-2-propen-1-one IUPAC Name: (E)-1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-(2-methoxyphenyl)-2-phenylprop-2-en-1-one Traditional Name: (E)-1-(4-benzhydrylpiperazin-4-ium-1-yl)-3-(2-methoxyphenyl)-2-phenyl-prop-2-en-1-one Formula: C33H33N2O2+ MolecularWeight: 489.62732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=C(C2=CC=CC=C2)C(=O)N3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1/C=C(\C2=CC=CC=C2)/C(=O)N3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H32N2O2/c1-37-31-20-12-11-19-29(31)25-30(26-13-5-2-6-14-26)33(36)35-23-21-34(22-24-35)32(27-15-7-3-8-16-27)28-17-9-4-10-18-28/h2-20,25,32H,21-24H2,1H3/p+1/b30-25+