N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2H-chromene-3-carboxamide

Systemtic Name: N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2H-chromene-3-carboxamide Openeye Name: N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2H-chromene-3-carboxamide CAS Name: N-[(1S)-2-(4-morpholin-4-iumyl)-1-phenylethyl]-2H-1-benzopyran-3-carboxamide IUPAC Name: N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]-2H-chromene-3-carboxamide Traditional Name: N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-2H-chromene-3-carboxamide Formula: C22H25N2O3+ MolecularWeight: 365.4455

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(C2=CC=CC=C2)NC(=O)C3=CC4=CC=CC=C4OC3

Isomeric SMILES

C1COCC[NH+]1C[C@H](C2=CC=CC=C2)NC(=O)C3=CC4=CC=CC=C4OC3

InChI

InChI=1S/C22H24N2O3/c25-22(19-14-18-8-4-5-9-21(18)27-16-19)23-20(17-6-2-1-3-7-17)15-24-10-12-26-13-11-24/h1-9,14,20H,10-13,15-16H2,(H,23,25)/p+1/t20-/m1/s1