N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N,1-dimethyl-indole-2-carboxamide

Systemtic Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N,1-dimethyl-indole-2-carboxamide Openeye Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N,1-dimethyl-indole-2-carboxamide CAS Name: N-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]-N,1-dimethyl-2-indolecarboxamide IUPAC Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-N,1-dimethylindole-2-carboxamide Traditional Name: N-[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-N,1-dimethyl-indole-2-carboxamide Formula: C23H27FN3O+ MolecularWeight: 380.478383

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1C(=O)N(C)C3CCC[NH+](C3)CC4=CC=CC=C4F

Isomeric SMILES

CN1C2=CC=CC=C2C=C1C(=O)N(C)[C@H]3CCC[NH+](C3)CC4=CC=CC=C4F

InChI

InChI=1S/C23H26FN3O/c1-25(23(28)22-14-17-8-4-6-12-21(17)26(22)2)19-10-7-13-27(16-19)15-18-9-3-5-11-20(18)24/h3-6,8-9,11-12,14,19H,7,10,13,15-16H2,1-2H3/p+1/t19-/m0/s1