dimethyl 2-[(R)-morpholin-4-ium-4-yl(phenyl)methyl]propanedioate

Systemtic Name: dimethyl 2-[(R)-morpholin-4-ium-4-yl(phenyl)methyl]propanedioate Openeye Name: dimethyl 2-[(R)-morpholin-4-ium-4-yl(phenyl)methyl]propanedioate CAS Name: 2-[(R)-4-morpholin-4-iumyl(phenyl)methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(R)-morpholin-4-ium-4-yl(phenyl)methyl]propanedioate Traditional Name: 2-[(R)-morpholin-4-ium-4-yl(phenyl)methyl]malonic acid dimethyl ester Formula: C16H22NO5+ MolecularWeight: 308.34958

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C1=CC=CC=C1)[NH+]2CCOCC2)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO5/c1-20-15(18)13(16(19)21-2)14(12-6-4-3-5-7-12)17-8-10-22-11-9-17/h3-7,13-14H,8-11H2,1-2H3/p+1/t14-/m0/s1