(E)-4-[3-(hydroxymethyl)piperidin-1-yl]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[3-(hydroxymethyl)piperidin-1-yl]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[3-(hydroxymethyl)-1-piperidyl]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[3-(hydroxymethyl)-1-piperidinyl]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[3-(hydroxymethyl)piperidin-1-yl]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-(3-methylolpiperidino)but-2-enoic acid Formula: C10H15NO4 MolecularWeight: 213.2304

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C=CC(=O)O)CO

Isomeric SMILES

C1CC(CN(C1)C(=O)/C=C/C(=O)O)CO

InChI

InChI=1S/C10H15NO4/c12-7-8-2-1-5-11(6-8)9(13)3-4-10(14)15/h3-4,8,12H,1-2,5-7H2,(H,14,15)/b4-3+