3,4-dimethoxy-N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]benzamide

Systemtic Name: 3,4-dimethoxy-N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]benzamide Openeye Name: 3,4-dimethoxy-N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]benzamide CAS Name: 3,4-dimethoxy-N-methyl-N-[(3S)-1-phenethyl-3-piperidin-1-iumyl]benzamide IUPAC Name: 3,4-dimethoxy-N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]benzamide Traditional Name: 3,4-dimethoxy-N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]benzamide Formula: C23H31N2O3+ MolecularWeight: 383.50384

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)CCC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)CCC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H30N2O3/c1-24(23(26)19-11-12-21(27-2)22(16-19)28-3)20-10-7-14-25(17-20)15-13-18-8-5-4-6-9-18/h4-6,8-9,11-12,16,20H,7,10,13-15,17H2,1-3H3/p+1/t20-/m0/s1