4-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-2-oxidanylidene-1-propyl-pyridine-3-carbaldehyde

Systemtic Name: 4-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-2-oxidanylidene-1-propyl-pyridine-3-carbaldehyde Openeye Name: 4-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-2-oxo-1-propyl-pyridine-3-carbaldehyde CAS Name: 4-(4-ethyl-1-piperazin-4-iumyl)-6-methyl-2-oxo-1-propyl-3-pyridinecarboxaldehyde IUPAC Name: 4-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-2-oxo-1-propylpyridine-3-carbaldehyde Traditional Name: 4-(4-ethylpiperazin-4-ium-1-yl)-2-keto-6-methyl-1-propyl-nicotinaldehyde Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C(C1=O)C=O)N2CC[NH+](CC2)CC)C

Isomeric SMILES

CCCN1C(=CC(=C(C1=O)C=O)N2CC[NH+](CC2)CC)C

InChI

InChI=1S/C16H25N3O2/c1-4-6-19-13(3)11-15(14(12-20)16(19)21)18-9-7-17(5-2)8-10-18/h11-12H,4-10H2,1-3H3/p+1