5-[methyl-[(5-methylfuran-2-yl)methyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[methyl-[(5-methylfuran-2-yl)methyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[methyl-[(5-methyl-2-furyl)methyl]amino]-5-oxo-pentanoic acid CAS Name: 5-[methyl-[(5-methyl-2-furanyl)methyl]amino]-5-oxopentanoic acid IUPAC Name: 5-[methyl-[(5-methylfuran-2-yl)methyl]amino]-5-oxopentanoic acid Traditional Name: 5-keto-5-[methyl-[(5-methyl-2-furyl)methyl]amino]valeric acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C)C(=O)CCCC(=O)O

Isomeric SMILES

CC1=CC=C(O1)CN(C)C(=O)CCCC(=O)O

InChI

InChI=1S/C12H17NO4/c1-9-6-7-10(17-9)8-13(2)11(14)4-3-5-12(15)16/h6-7H,3-5,8H2,1-2H3,(H,15,16)