N-methyl-1-phenyl-1-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-ylidene]methanamine

Systemtic Name: N-methyl-1-phenyl-1-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-ylidene]methanamine Openeye Name: 1-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-ylidene]-N-methyl-1-phenyl-methanamine CAS Name: N-methyl-1-phenyl-1-[4-[(E)-3-phenylprop-2-enyl]-1-piperazine-1,4-diiumylidene]methanamine IUPAC Name: N-methyl-1-phenyl-1-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-ylidene]methanamine Traditional Name: [[4-[(E)-cinnamyl]piperazine-1,4-diium-1-ylidene]-phenyl-methyl]-methyl-amine Formula: C21H27N3+2 MolecularWeight: 321.45918

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=[N+]1CC[NH+](CC1)CC=CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CNC(=[N+]1CC[NH+](CC1)C/C=C/C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3/c1-22-21(20-12-6-3-7-13-20)24-17-15-23(16-18-24)14-8-11-19-9-4-2-5-10-19/h2-13H,14-18H2,1H3/p+2/b11-8+