4-bromanyl-6-[[[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-bromanyl-6-[[[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-6-[[[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-6-[[[(2R)-2-(4-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-6-[[[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[[[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C20H24BrN2O3+ MolecularWeight: 420.32016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC=C2C=C(C=CC2=O)Br)[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC=C2C=C(C=CC2=O)Br)[NH+]3CCOCC3

InChI

InChI=1S/C20H23BrN2O3/c1-25-18-5-2-15(3-6-18)19(23-8-10-26-11-9-23)14-22-13-16-12-17(21)4-7-20(16)24/h2-7,12-13,19,22H,8-11,14H2,1H3/p+1/t19-/m0/s1