methyl 2-[2-[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbonyloxyethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbonyloxyethanoylamino]benzoate Openeye Name: methyl 2-[[2-[4-(morpholin-4-ium-4-ylmethyl)benzoyl]oxyacetyl]amino]benzoate CAS Name: 2-[[2-[[4-(4-morpholin-4-iumylmethyl)phenyl]-oxomethoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(morpholin-4-ium-4-ylmethyl)benzoyl]oxyacetyl]amino]benzoate Traditional Name: 2-[[2-[4-(morpholin-4-ium-4-ylmethyl)benzoyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C22H25N2O6+ MolecularWeight: 413.4437

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)COC(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)COC(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C22H24N2O6/c1-28-22(27)18-4-2-3-5-19(18)23-20(25)15-30-21(26)17-8-6-16(7-9-17)14-24-10-12-29-13-11-24/h2-9H,10-15H2,1H3,(H,23,25)/p+1