(1-methylpyrrol-2-yl)methyl-[(1S)-1-pyridin-4-ylethyl]azanium

Systemtic Name: (1-methylpyrrol-2-yl)methyl-[(1S)-1-pyridin-4-ylethyl]azanium Openeye Name: (1-methylpyrrol-2-yl)methyl-[(1S)-1-(4-pyridyl)ethyl]ammonium CAS Name: (1-methyl-2-pyrrolyl)methyl-[(1S)-1-pyridin-4-ylethyl]ammonium IUPAC Name: (1-methylpyrrol-2-yl)methyl-[(1S)-1-pyridin-4-ylethyl]azanium Traditional Name: (1-methylpyrrol-2-yl)methyl-[(1S)-1-(4-pyridyl)ethyl]ammonium Formula: C13H18N3+ MolecularWeight: 216.30212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)[NH2+]CC2=CC=CN2C

Isomeric SMILES

C[C@@H](C1=CC=NC=C1)[NH2+]CC2=CC=CN2C

InChI

InChI=1S/C13H17N3/c1-11(12-5-7-14-8-6-12)15-10-13-4-3-9-16(13)2/h3-9,11,15H,10H2,1-2H3/p+1/t11-/m0/s1