N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-oxo-chromene-3-carboxamide CAS Name: N-[(2R)-2-(4-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]-4-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]-4-oxochromene-3-carboxamide Traditional Name: 4-keto-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]chromene-3-carboxamide Formula: C23H25N2O5+ MolecularWeight: 409.455

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=COC3=CC=CC=C3C2=O)[NH+]4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=COC3=CC=CC=C3C2=O)[NH+]4CCOCC4

InChI

InChI=1S/C23H24N2O5/c1-28-17-8-6-16(7-9-17)20(25-10-12-29-13-11-25)14-24-23(27)19-15-30-21-5-3-2-4-18(21)22(19)26/h2-9,15,20H,10-14H2,1H3,(H,24,27)/p+1/t20-/m0/s1