(Z,2R)-2-(4-methylpiperazin-1-ium-1-yl)-4-phenyl-1-piperazin-1-yl-but-3-en-1-one

Systemtic Name: (Z,2R)-2-(4-methylpiperazin-1-ium-1-yl)-4-phenyl-1-piperazin-1-yl-but-3-en-1-one Openeye Name: (Z,2R)-2-(4-methylpiperazin-1-ium-1-yl)-4-phenyl-1-piperazin-1-yl-but-3-en-1-one CAS Name: (Z,2R)-2-(4-methyl-1-piperazin-1-iumyl)-4-phenyl-1-(1-piperazinyl)-3-buten-1-one IUPAC Name: (Z,2R)-2-(4-methylpiperazin-1-ium-1-yl)-4-phenyl-1-piperazin-1-ylbut-3-en-1-one Traditional Name: (Z,2R)-2-(4-methylpiperazin-1-ium-1-yl)-4-phenyl-1-piperazino-but-3-en-1-one Formula: C19H29N4O+ MolecularWeight: 329.45976

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)C(C=CC2=CC=CC=C2)C(=O)N3CCNCC3

Isomeric SMILES

CN1CC[NH+](CC1)[C@H](/C=C\C2=CC=CC=C2)C(=O)N3CCNCC3

InChI

InChI=1S/C19H28N4O/c1-21-13-15-22(16-14-21)18(8-7-17-5-3-2-4-6-17)19(24)23-11-9-20-10-12-23/h2-8,18,20H,9-16H2,1H3/p+1/b8-7-/t18-/m1/s1