N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-5-methyl-pyrazine-2-carboxamide

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-5-methyl-pyrazine-2-carboxamide Openeye Name: N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-5-methyl-pyrazine-2-carboxamide CAS Name: N-[(2R)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-5-methyl-2-pyrazinecarboxamide IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-5-methylpyrazine-2-carboxamide Traditional Name: N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-5-methyl-pyrazinamide Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)NCC(C2=CC=CO2)[NH+]3CCCCC3

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)NC[C@H](C2=CC=CO2)[NH+]3CCCCC3

InChI

InChI=1S/C17H22N4O2/c1-13-10-19-14(11-18-13)17(22)20-12-15(16-6-5-9-23-16)21-7-3-2-4-8-21/h5-6,9-11,15H,2-4,7-8,12H2,1H3,(H,20,22)/p+1/t15-/m1/s1