N-[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-yl]-4-oxidanylidene-chromene-2-carboxamide

Systemtic Name: N-[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-yl]-4-oxidanylidene-chromene-2-carboxamide Openeye Name: N-[(1R,2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]-4-oxo-chromene-2-carboxamide CAS Name: N-[(1S,2R)-1-(4-morpholin-4-iumyl)-1-phenylpropan-2-yl]-4-oxo-1-benzopyran-2-carboxamide IUPAC Name: N-[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenylpropan-2-yl]-4-oxochromene-2-carboxamide Traditional Name: 4-keto-N-[(1R,2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]chromene-2-carboxamide Formula: C23H25N2O4+ MolecularWeight: 393.4556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)[NH+]2CCOCC2)NC(=O)C3=CC(=O)C4=CC=CC=C4O3

Isomeric SMILES

C[C@H]([C@H](C1=CC=CC=C1)[NH+]2CCOCC2)NC(=O)C3=CC(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C23H24N2O4/c1-16(22(17-7-3-2-4-8-17)25-11-13-28-14-12-25)24-23(27)21-15-19(26)18-9-5-6-10-20(18)29-21/h2-10,15-16,22H,11-14H2,1H3,(H,24,27)/p+1/t16-,22-/m1/s1