N-[2-[1-[(4,5-dimethylfuran-2-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-methoxy-benzamide

Systemtic Name: N-[2-[1-[(4,5-dimethylfuran-2-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-methoxy-benzamide Openeye Name: N-[2-[1-[(4,5-dimethyl-2-furyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-methoxy-benzamide CAS Name: N-[2-[1-[(4,5-dimethyl-2-furanyl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]-2-methoxybenzamide IUPAC Name: N-[2-[1-[(4,5-dimethylfuran-2-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-methoxybenzamide Traditional Name: N-[2-[1-[(4,5-dimethyl-2-furyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2-methoxy-benzamide Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC=CC=C4OC)C

Isomeric SMILES

CC1=C(OC(=C1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC=CC=C4OC)C

InChI

InChI=1S/C23H28N4O3/c1-16-14-19(30-17(16)2)15-26-12-9-18(10-13-26)27-22(8-11-24-27)25-23(28)20-6-4-5-7-21(20)29-3/h4-8,11,14,18H,9-10,12-13,15H2,1-3H3,(H,25,28)/p+1