(Z)-2-methyl-3-phenyl-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]prop-2-en-1-one

Systemtic Name: (Z)-2-methyl-3-phenyl-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]prop-2-en-1-one Openeye Name: (Z)-1-(4-benzylpiperazin-4-ium-1-yl)-2-methyl-3-phenyl-prop-2-en-1-one CAS Name: (Z)-2-methyl-3-phenyl-1-[4-(phenylmethyl)-1-piperazin-4-iumyl]-2-propen-1-one IUPAC Name: (Z)-1-(4-benzylpiperazin-4-ium-1-yl)-2-methyl-3-phenylprop-2-en-1-one Traditional Name: (Z)-1-(4-benzylpiperazin-4-ium-1-yl)-2-methyl-3-phenyl-prop-2-en-1-one Formula: C21H25N2O+ MolecularWeight: 321.436

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

C/C(=C/C1=CC=CC=C1)/C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O/c1-18(16-19-8-4-2-5-9-19)21(24)23-14-12-22(13-15-23)17-20-10-6-3-7-11-20/h2-11,16H,12-15,17H2,1H3/p+1/b18-16-