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

Systemtic Name: 4-methoxy-6-[[[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-methoxy-6-[[[(1R,2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-methoxy-6-[[[(1S,2R)-1-(4-morpholin-4-iumyl)-1-phenylpropan-2-yl]amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-methoxy-6-[[[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenylpropan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-methoxy-6-[[[(1R,2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)[NH+]2CCOCC2)NC=C3C=C(C=CC3=O)OC

Isomeric SMILES

C[C@H]([C@H](C1=CC=CC=C1)[NH+]2CCOCC2)NC=C3C=C(C=CC3=O)OC

InChI

InChI=1S/C21H26N2O3/c1-16(22-15-18-14-19(25-2)8-9-20(18)24)21(17-6-4-3-5-7-17)23-10-12-26-13-11-23/h3-9,14-16,21-22H,10-13H2,1-2H3/p+1/t16-,21-/m1/s1