N-(dimethylaminomethyl)-4-[(6-fluoranylcyclohex-2-en-1-yl)methylidene]-1-[3-(1H-indol-3-yl)-1-oxidanylidene-1-(4H-quinolin-1-yl)propan-2-yl]piperidin-1-ium-1-carboxamide

Systemtic Name: N-(dimethylaminomethyl)-4-[(6-fluoranylcyclohex-2-en-1-yl)methylidene]-1-[3-(1H-indol-3-yl)-1-oxidanylidene-1-(4H-quinolin-1-yl)propan-2-yl]piperidin-1-ium-1-carboxamide Openeye Name: N-(dimethylaminomethyl)-4-[(6-fluorocyclohex-2-en-1-yl)methylene]-1-[1-(1H-indol-3-ylmethyl)-2-oxo-2-(4H-quinolin-1-yl)ethyl]piperidin-1-ium-1-carboxamide CAS Name: N-(dimethylaminomethyl)-4-[(6-fluoro-1-cyclohex-2-enyl)methylidene]-1-[3-(1H-indol-3-yl)-1-oxo-1-(4H-quinolin-1-yl)propan-2-yl]-1-piperidin-1-iumcarboxamide IUPAC Name: N-(dimethylaminomethyl)-4-[(6-fluorocyclohex-2-en-1-yl)methylidene]-1-[3-(1H-indol-3-yl)-1-oxo-1-(4H-quinolin-1-yl)propan-2-yl]piperidin-1-ium-1-carboxamide Traditional Name: N-(dimethylaminomethyl)-4-[(6-fluorocyclohex-2-en-1-yl)methylene]-1-[1-(1H-indol-3-ylmethyl)-2-keto-2-(4H-quinolin-1-yl)ethyl]piperidin-1-ium-1-carboxamide Formula: C36H43FN5O2+ MolecularWeight: 596.757323

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CNC(=O)[N+]1(CCC(=CC2C=CCCC2F)CC1)C(CC3=CNC4=CC=CC=C43)C(=O)N5C=CCC6=CC=CC=C65

Isomeric SMILES

CN(C)CNC(=O)[N+]1(CCC(=CC2C=CCCC2F)CC1)C(CC3=CNC4=CC=CC=C43)C(=O)N5C=CCC6=CC=CC=C65

InChI

InChI=1S/C36H42FN5O2/c1-40(2)25-39-36(44)42(20-17-26(18-21-42)22-28-11-3-6-14-31(28)37)34(23-29-24-38-32-15-7-5-13-30(29)32)35(43)41-19-9-12-27-10-4-8-16-33(27)41/h3-5,7-11,13,15-16,19,22,24,28,31,34,38H,6,12,14,17-18,20-21,23,25H2,1-2H3/p+1