N-[(2S)-1-methoxypropan-2-yl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-[(2S)-1-methoxypropan-2-yl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-[(1S)-2-methoxy-1-methyl-ethyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide CAS Name: N-[(2S)-1-methoxypropan-2-yl]-4-[(1-phenethyl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-[(2S)-1-methoxypropan-2-yl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-[(1S)-2-methoxy-1-methyl-ethyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C24H33N2O3+ MolecularWeight: 397.53042

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC(=O)C1=CC=C(C=C1)OC2CC[NH+](CC2)CCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](COC)NC(=O)C1=CC=C(C=C1)OC2CC[NH+](CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C24H32N2O3/c1-19(18-28-2)25-24(27)21-8-10-22(11-9-21)29-23-13-16-26(17-14-23)15-12-20-6-4-3-5-7-20/h3-11,19,23H,12-18H2,1-2H3,(H,25,27)/p+1/t19-/m0/s1