3-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzo[g][1]benzofuran-2-carboxamide

Systemtic Name: 3-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzo[g][1]benzofuran-2-carboxamide Openeye Name: 3-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzo[g]benzofuran-2-carboxamide CAS Name: 3-methyl-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-2-benzo[g]benzofurancarboxamide IUPAC Name: 3-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzo[g][1]benzofuran-2-carboxamide Traditional Name: 3-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzo[g]benzofuran-2-carboxamide Formula: C23H29N2O2+ MolecularWeight: 365.48856

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)C2=C(C3=C(O2)C4=CC=CC=C4C=C3)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)C2=C(C3=C(O2)C4=CC=CC=C4C=C3)C

InChI

InChI=1S/C23H28N2O2/c1-16-8-5-6-14-25(16)15-7-13-24-23(26)21-17(2)19-12-11-18-9-3-4-10-20(18)22(19)27-21/h3-4,9-12,16H,5-8,13-15H2,1-2H3,(H,24,26)/p+1/t16-/m0/s1