2-methyl-5-(morpholin-4-ium-4-ylmethyl)furan-3-carboxylic acid

Systemtic Name: 2-methyl-5-(morpholin-4-ium-4-ylmethyl)furan-3-carboxylic acid Openeye Name: 2-methyl-5-(morpholin-4-ium-4-ylmethyl)furan-3-carboxylic acid CAS Name: 2-methyl-5-(4-morpholin-4-iumylmethyl)-3-furancarboxylic acid IUPAC Name: 2-methyl-5-(morpholin-4-ium-4-ylmethyl)furan-3-carboxylic acid Traditional Name: 2-methyl-5-(morpholin-4-ium-4-ylmethyl)-3-furoic acid Formula: C11H16NO4+ MolecularWeight: 226.24904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C[NH+]2CCOCC2)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)C[NH+]2CCOCC2)C(=O)O

InChI

InChI=1S/C11H15NO4/c1-8-10(11(13)14)6-9(16-8)7-12-2-4-15-5-3-12/h6H,2-5,7H2,1H3,(H,13,14)/p+1