N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-1-[(5-methyl-2-furanyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-carboxamide Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)N4C(=CC(=N4)C)C

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)N4C(=CC(=N4)C)C

InChI

InChI=1S/C23H28N4O2/c1-16-14-17(2)27(25-16)21-7-5-20(6-8-21)24-23(28)19-10-12-26(13-11-19)15-22-9-4-18(3)29-22/h4-9,14,19H,10-13,15H2,1-3H3,(H,24,28)/p+1