3-[4-cyano-4-(2-methoxyphenyl)piperazin-4-ium-1-yl]-N-phenyl-propanamide

Systemtic Name: 3-[4-cyano-4-(2-methoxyphenyl)piperazin-4-ium-1-yl]-N-phenyl-propanamide Openeye Name: 3-[4-cyano-4-(2-methoxyphenyl)piperazin-4-ium-1-yl]-N-phenyl-propanamide CAS Name: 3-[4-cyano-4-(2-methoxyphenyl)-1-piperazin-4-iumyl]-N-phenylpropanamide IUPAC Name: 3-[4-cyano-4-(2-methoxyphenyl)piperazin-4-ium-1-yl]-N-phenylpropanamide Traditional Name: 3-[4-cyano-4-(2-methoxyphenyl)piperazin-4-ium-1-yl]-N-phenyl-propionamide Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1[N+]2(CCN(CC2)CCC(=O)NC3=CC=CC=C3)C#N

Isomeric SMILES

COC1=CC=CC=C1[N+]2(CCN(CC2)CCC(=O)NC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H24N4O2/c1-27-20-10-6-5-9-19(20)25(17-22)15-13-24(14-16-25)12-11-21(26)23-18-7-3-2-4-8-18/h2-10H,11-16H2,1H3/p+1