(E)-4-methyl-5-oxidanylidene-5-piperidin-1-yl-pent-2-enoic acid

Systemtic Name: (E)-4-methyl-5-oxidanylidene-5-piperidin-1-yl-pent-2-enoic acid Openeye Name: (E)-4-methyl-5-oxo-5-(1-piperidyl)pent-2-enoic acid CAS Name: (E)-4-methyl-5-oxo-5-(1-piperidinyl)-2-pentenoic acid IUPAC Name: (E)-4-methyl-5-oxo-5-piperidin-1-ylpent-2-enoic acid Traditional Name: (E)-5-keto-4-methyl-5-piperidino-pent-2-enoic acid Formula: C11H17NO3 MolecularWeight: 211.25758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CC(=O)O)C(=O)N1CCCCC1

Isomeric SMILES

CC(/C=C/C(=O)O)C(=O)N1CCCCC1

InChI

InChI=1S/C11H17NO3/c1-9(5-6-10(13)14)11(15)12-7-3-2-4-8-12/h5-6,9H,2-4,7-8H2,1H3,(H,13,14)/b6-5+