N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-5-methoxy-N,1-dimethyl-indole-2-carboxamide

Systemtic Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-5-methoxy-N,1-dimethyl-indole-2-carboxamide Openeye Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-5-methoxy-N,1-dimethyl-indole-2-carboxamide CAS Name: N-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]-5-methoxy-N,1-dimethyl-2-indolecarboxamide IUPAC Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-5-methoxy-N,1-dimethylindole-2-carboxamide Traditional Name: N-[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-5-methoxy-N,1-dimethyl-indole-2-carboxamide Formula: C24H29FN3O2+ MolecularWeight: 410.504363

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)C=C1C(=O)N(C)C3CCC[NH+](C3)CC4=CC=CC=C4F

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)C=C1C(=O)N(C)[C@H]3CCC[NH+](C3)CC4=CC=CC=C4F

InChI

InChI=1S/C24H28FN3O2/c1-26(19-8-6-12-28(16-19)15-17-7-4-5-9-21(17)25)24(29)23-14-18-13-20(30-3)10-11-22(18)27(23)2/h4-5,7,9-11,13-14,19H,6,8,12,15-16H2,1-3H3/p+1/t19-/m0/s1