1-[(1-methylpyrrol-2-yl)methyl]-4-propan-2-yl-piperazine-1,4-diium

Systemtic Name: 1-[(1-methylpyrrol-2-yl)methyl]-4-propan-2-yl-piperazine-1,4-diium Openeye Name: 1-isopropyl-4-[(1-methylpyrrol-2-yl)methyl]piperazine-1,4-diium CAS Name: 1-[(1-methyl-2-pyrrolyl)methyl]-4-propan-2-ylpiperazine-1,4-diium IUPAC Name: 1-[(1-methylpyrrol-2-yl)methyl]-4-propan-2-ylpiperazine-1,4-diium Traditional Name: 1-isopropyl-4-[(1-methylpyrrol-2-yl)methyl]piperazine-1,4-diium Formula: C13H25N3+2 MolecularWeight: 223.3577

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CC[NH+](CC1)CC2=CC=CN2C

Isomeric SMILES

CC(C)[NH+]1CC[NH+](CC1)CC2=CC=CN2C

InChI

InChI=1S/C13H23N3/c1-12(2)16-9-7-15(8-10-16)11-13-5-4-6-14(13)3/h4-6,12H,7-11H2,1-3H3/p+2