N-[3-(furan-2-yl)phenyl]-1-[(3,5,6-trimethylpyrazin-2-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[3-(furan-2-yl)phenyl]-1-[(3,5,6-trimethylpyrazin-2-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[3-(2-furyl)phenyl]-1-[(3,5,6-trimethylpyrazin-2-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[3-(2-furanyl)phenyl]-1-[(3,5,6-trimethyl-2-pyrazinyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[3-(furan-2-yl)phenyl]-1-[(3,5,6-trimethylpyrazin-2-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-[3-(2-furyl)phenyl]-1-[(3,5,6-trimethylpyrazin-2-yl)methyl]piperidin-1-ium-4-carboxamide Formula: C24H29N4O2+ MolecularWeight: 405.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=N1)C)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC=CO4)C

Isomeric SMILES

CC1=C(N=C(C(=N1)C)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC=CO4)C

InChI

InChI=1S/C24H28N4O2/c1-16-17(2)26-22(18(3)25-16)15-28-11-9-19(10-12-28)24(29)27-21-7-4-6-20(14-21)23-8-5-13-30-23/h4-8,13-14,19H,9-12,15H2,1-3H3,(H,27,29)/p+1