4-(2-piperazin-4-ium-1-ylphenyl)carbonylpiperazine-1-carbaldehyde

Systemtic Name: 4-(2-piperazin-4-ium-1-ylphenyl)carbonylpiperazine-1-carbaldehyde Openeye Name: 4-(2-piperazin-4-ium-1-ylbenzoyl)piperazine-1-carbaldehyde CAS Name: 4-[oxo-[2-(1-piperazin-4-iumyl)phenyl]methyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-(2-piperazin-4-ium-1-ylbenzoyl)piperazine-1-carbaldehyde Traditional Name: 4-(2-piperazin-4-ium-1-ylbenzoyl)piperazine-1-carbaldehyde Formula: C16H23N4O2+ MolecularWeight: 303.37942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC=CC=C2C(=O)N3CCN(CC3)C=O

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC=CC=C2C(=O)N3CCN(CC3)C=O

InChI

InChI=1S/C16H22N4O2/c21-13-18-9-11-20(12-10-18)16(22)14-3-1-2-4-15(14)19-7-5-17-6-8-19/h1-4,13,17H,5-12H2/p+1