6-chloranyl-N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-2H-chromene-3-carboxamide

Systemtic Name: 6-chloranyl-N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-2H-chromene-3-carboxamide Openeye Name: 6-chloro-N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-2H-chromene-3-carboxamide CAS Name: 6-chloro-N-[(2R)-2-(4-fluorophenyl)-2-(4-morpholin-4-iumyl)ethyl]-2H-1-benzopyran-3-carboxamide IUPAC Name: 6-chloro-N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-ylethyl]-2H-chromene-3-carboxamide Traditional Name: 6-chloro-N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-2H-chromene-3-carboxamide Formula: C22H23ClFN2O3+ MolecularWeight: 417.881023

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=CC3=C(C=CC(=C3)Cl)OC2)C4=CC=C(C=C4)F

Isomeric SMILES

C1COCC[NH+]1[C@@H](CNC(=O)C2=CC3=C(C=CC(=C3)Cl)OC2)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H22ClFN2O3/c23-18-3-6-21-16(12-18)11-17(14-29-21)22(27)25-13-20(26-7-9-28-10-8-26)15-1-4-19(24)5-2-15/h1-6,11-12,20H,7-10,13-14H2,(H,25,27)/p+1/t20-/m0/s1