(E)-4-[(3S)-3-ethoxycarbonylpiperidin-1-yl]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(3S)-3-ethoxycarbonylpiperidin-1-yl]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[(3S)-3-ethoxycarbonyl-1-piperidyl]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(3S)-3-ethoxycarbonyl-1-piperidinyl]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(3S)-3-ethoxycarbonylpiperidin-1-yl]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[(3S)-3-carbethoxypiperidino]-4-keto-but-2-enoic acid Formula: C12H17NO5 MolecularWeight: 255.26708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C=CC(=O)O

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C12H17NO5/c1-2-18-12(17)9-4-3-7-13(8-9)10(14)5-6-11(15)16/h5-6,9H,2-4,7-8H2,1H3,(H,15,16)/b6-5+/t9-/m0/s1