N-[(1,5-dimethylpyrazol-3-yl)methyl]-4-methoxy-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-[(1,5-dimethylpyrazol-3-yl)methyl]-4-methoxy-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-[(1,5-dimethylpyrazol-3-yl)methyl]-3-(1-isopropylpiperidin-1-ium-4-yl)oxy-4-methoxy-benzamide CAS Name: N-[(1,5-dimethyl-3-pyrazolyl)methyl]-4-methoxy-3-[(1-propan-2-yl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-[(1,5-dimethylpyrazol-3-yl)methyl]-4-methoxy-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-[(1,5-dimethylpyrazol-3-yl)methyl]-3-(1-isopropylpiperidin-1-ium-4-yl)oxy-4-methoxy-benzamide Formula: C22H33N4O3+ MolecularWeight: 401.52242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)CNC(=O)C2=CC(=C(C=C2)OC)OC3CC[NH+](CC3)C(C)C

Isomeric SMILES

CC1=CC(=NN1C)CNC(=O)C2=CC(=C(C=C2)OC)OC3CC[NH+](CC3)C(C)C

InChI

InChI=1S/C22H32N4O3/c1-15(2)26-10-8-19(9-11-26)29-21-13-17(6-7-20(21)28-5)22(27)23-14-18-12-16(3)25(4)24-18/h6-7,12-13,15,19H,8-11,14H2,1-5H3,(H,23,27)/p+1