N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]pyrazine-2-carboxamide

Systemtic Name: N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]pyrazine-2-carboxamide Openeye Name: N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]pyrazine-2-carboxamide CAS Name: N-methyl-N-[(3S)-1-phenethyl-3-piperidin-1-iumyl]-2-pyrazinecarboxamide IUPAC Name: N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]pyrazine-2-carboxamide Traditional Name: N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]pyrazinamide Formula: C19H25N4O+ MolecularWeight: 325.428

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)CCC2=CC=CC=C2)C(=O)C3=NC=CN=C3

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)CCC2=CC=CC=C2)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C19H24N4O/c1-22(19(24)18-14-20-10-11-21-18)17-8-5-12-23(15-17)13-9-16-6-3-2-4-7-16/h2-4,6-7,10-11,14,17H,5,8-9,12-13,15H2,1H3/p+1/t17-/m0/s1