3-[2-(morpholin-4-ium-4-ylmethyl)pyrrol-1-yl]propanenitrile

Systemtic Name: 3-[2-(morpholin-4-ium-4-ylmethyl)pyrrol-1-yl]propanenitrile Openeye Name: 3-[2-(morpholin-4-ium-4-ylmethyl)pyrrol-1-yl]propanenitrile CAS Name: 3-[2-(4-morpholin-4-iumylmethyl)-1-pyrrolyl]propanenitrile IUPAC Name: 3-[2-(morpholin-4-ium-4-ylmethyl)pyrrol-1-yl]propanenitrile Traditional Name: 3-[2-(morpholin-4-ium-4-ylmethyl)pyrrol-1-yl]propionitrile Formula: C12H18N3O+ MolecularWeight: 220.29082

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CN2CCC#N

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CN2CCC#N

InChI

InChI=1S/C12H17N3O/c13-4-2-6-15-5-1-3-12(15)11-14-7-9-16-10-8-14/h1,3,5H,2,6-11H2/p+1