5-[(2S)-1-methylpyrrolidin-1-ium-2-yl]pyridine-3-carbaldehyde

Systemtic Name: 5-[(2S)-1-methylpyrrolidin-1-ium-2-yl]pyridine-3-carbaldehyde Openeye Name: 5-[(2S)-1-methylpyrrolidin-1-ium-2-yl]pyridine-3-carbaldehyde CAS Name: 5-[(2S)-1-methyl-2-pyrrolidin-1-iumyl]-3-pyridinecarboxaldehyde IUPAC Name: 5-[(2S)-1-methylpyrrolidin-1-ium-2-yl]pyridine-3-carbaldehyde Traditional Name: 5-[(2S)-1-methylpyrrolidin-1-ium-2-yl]nicotinaldehyde Formula: C11H15N2O+ MolecularWeight: 191.2496

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC1C2=CN=CC(=C2)C=O

Isomeric SMILES

C[NH+]1CCC[C@H]1C2=CN=CC(=C2)C=O

InChI

InChI=1S/C11H14N2O/c1-13-4-2-3-11(13)10-5-9(8-14)6-12-7-10/h5-8,11H,2-4H2,1H3/p+1/t11-/m0/s1