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N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-3-pyrazin-2-yl-propanamide

N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-3-pyrazin-2-yl-propanamide

Systemtic Name:N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-3-pyrazin-2-yl-propanamide
Openeye Name:N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-3-pyrazin-2-yl-propanamide
CAS Name:N-[(3S)-1-phenethyl-3-piperidin-1-iumyl]-3-(2-pyrazinyl)propanamide
IUPAC Name:N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-3-pyrazin-2-ylpropanamide
Traditional Name:N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-3-pyrazin-2-yl-propionamide
Formula: C20H27N4O+
MolecularWeight: 339.45458
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CCC2=CC=CC=C2)NC(=O)CCC3=NC=CN=C3


Isomeric SMILES

C1C[C@@H](C[NH+](C1)CCC2=CC=CC=C2)NC(=O)CCC3=NC=CN=C3


InChI

InChI=1S/C20H26N4O/c25-20(9-8-18-15-21-11-12-22-18)23-19-7-4-13-24(16-19)14-10-17-5-2-1-3-6-17/h1-3,5-6,11-12,15,19H,4,7-10,13-14,16H2,(H,23,25)/p+1/t19-/m0/s1


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