6-bromanyl-N-[(2S)-2-(furan-2-yl)-2-morpholin-4-ium-4-yl-ethyl]-4-oxidanylidene-chromene-2-carboxamide

Systemtic Name: 6-bromanyl-N-[(2S)-2-(furan-2-yl)-2-morpholin-4-ium-4-yl-ethyl]-4-oxidanylidene-chromene-2-carboxamide Openeye Name: 6-bromo-N-[(2S)-2-(2-furyl)-2-morpholin-4-ium-4-yl-ethyl]-4-oxo-chromene-2-carboxamide CAS Name: 6-bromo-N-[(2S)-2-(2-furanyl)-2-(4-morpholin-4-iumyl)ethyl]-4-oxo-1-benzopyran-2-carboxamide IUPAC Name: 6-bromo-N-[(2S)-2-(furan-2-yl)-2-morpholin-4-ium-4-ylethyl]-4-oxochromene-2-carboxamide Traditional Name: 6-bromo-N-[(2S)-2-(2-furyl)-2-morpholin-4-ium-4-yl-ethyl]-4-keto-chromene-2-carboxamide Formula: C20H20BrN2O5+ MolecularWeight: 448.2872

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)Br)C4=CC=CO4

Isomeric SMILES

C1COCC[NH+]1[C@@H](CNC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)Br)C4=CC=CO4

InChI

InChI=1S/C20H19BrN2O5/c21-13-3-4-17-14(10-13)16(24)11-19(28-17)20(25)22-12-15(18-2-1-7-27-18)23-5-8-26-9-6-23/h1-4,7,10-11,15H,5-6,8-9,12H2,(H,22,25)/p+1/t15-/m0/s1