N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1H-indole-3-carboxamide

Systemtic Name: N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1H-indole-3-carboxamide Openeye Name: N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1H-indole-3-carboxamide CAS Name: N-methyl-N-[(3S)-1-phenethyl-3-piperidin-1-iumyl]-1H-indole-3-carboxamide IUPAC Name: N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1H-indole-3-carboxamide Traditional Name: N-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1H-indole-3-carboxamide Formula: C23H28N3O+ MolecularWeight: 362.48792

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)CCC2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)CCC2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C23H27N3O/c1-25(23(27)21-16-24-22-12-6-5-11-20(21)22)19-10-7-14-26(17-19)15-13-18-8-3-2-4-9-18/h2-6,8-9,11-12,16,19,24H,7,10,13-15,17H2,1H3/p+1/t19-/m0/s1