2-ethoxy-6-[[[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 2-ethoxy-6-[[[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 2-ethoxy-6-[[[(1R,2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 2-ethoxy-6-[[[(1S,2R)-1-(4-morpholin-4-iumyl)-1-phenylpropan-2-yl]amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 2-ethoxy-6-[[[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenylpropan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 2-ethoxy-6-[[[(1R,2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C22H29N2O3+ MolecularWeight: 369.47726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=CNC(C)C(C2=CC=CC=C2)[NH+]3CCOCC3)C1=O

Isomeric SMILES

CCOC1=CC=CC(=CN[C@H](C)[C@H](C2=CC=CC=C2)[NH+]3CCOCC3)C1=O

InChI

InChI=1S/C22H28N2O3/c1-3-27-20-11-7-10-19(22(20)25)16-23-17(2)21(18-8-5-4-6-9-18)24-12-14-26-15-13-24/h4-11,16-17,21,23H,3,12-15H2,1-2H3/p+1/t17-,21-/m1/s1