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

Systemtic Name: 4-methoxy-N-[(5-methylpyrazin-2-yl)methyl]-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: 3-(1-isopropylpiperidin-1-ium-4-yl)oxy-4-methoxy-N-[(5-methylpyrazin-2-yl)methyl]benzamide CAS Name: 4-methoxy-N-[(5-methyl-2-pyrazinyl)methyl]-3-[(1-propan-2-yl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: 4-methoxy-N-[(5-methylpyrazin-2-yl)methyl]-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: 3-(1-isopropylpiperidin-1-ium-4-yl)oxy-4-methoxy-N-[(5-methylpyrazin-2-yl)methyl]benzamide Formula: C22H31N4O3+ MolecularWeight: 399.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)CNC(=O)C2=CC(=C(C=C2)OC)OC3CC[NH+](CC3)C(C)C

Isomeric SMILES

CC1=CN=C(C=N1)CNC(=O)C2=CC(=C(C=C2)OC)OC3CC[NH+](CC3)C(C)C

InChI

InChI=1S/C22H30N4O3/c1-15(2)26-9-7-19(8-10-26)29-21-11-17(5-6-20(21)28-4)22(27)25-14-18-13-23-16(3)12-24-18/h5-6,11-13,15,19H,7-10,14H2,1-4H3,(H,25,27)/p+1