1-methyl-4-(1H-pyrrol-2-ylmethyl)piperazin-1-ium

Systemtic Name: 1-methyl-4-(1H-pyrrol-2-ylmethyl)piperazin-1-ium Openeye Name: 1-methyl-4-(1H-pyrrol-2-ylmethyl)piperazin-1-ium CAS Name: 1-methyl-4-(1H-pyrrol-2-ylmethyl)piperazin-1-ium IUPAC Name: 1-methyl-4-(1H-pyrrol-2-ylmethyl)piperazin-1-ium Traditional Name: 1-methyl-4-(1H-pyrrol-2-ylmethyl)piperazin-1-ium Formula: C10H18N3+ MolecularWeight: 180.27002

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC2=CC=CN2

Isomeric SMILES

C[NH+]1CCN(CC1)CC2=CC=CN2

InChI

InChI=1S/C10H17N3/c1-12-5-7-13(8-6-12)9-10-3-2-4-11-10/h2-4,11H,5-9H2,1H3/p+1