(E)-4-[[(3S)-3-ethoxycarbonylpiperidin-1-yl]carbonylamino]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[[(3S)-3-ethoxycarbonylpiperidin-1-yl]carbonylamino]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[[(3S)-3-ethoxycarbonylpiperidine-1-carbonyl]amino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[[(3S)-3-ethoxycarbonyl-1-piperidinyl]-oxomethyl]amino]-4-oxo-2-butenoate IUPAC Name: (E)-4-[[(3S)-3-ethoxycarbonylpiperidine-1-carbonyl]amino]-4-oxobut-2-enoate Traditional Name: (E)-4-[[(3S)-3-carbethoxypiperidine-1-carbonyl]amino]-4-keto-but-2-enoate Formula: C13H17N2O6- MolecularWeight: 297.28388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)NC(=O)C=CC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O6/c1-2-21-12(19)9-4-3-7-15(8-9)13(20)14-10(16)5-6-11(17)18/h5-6,9H,2-4,7-8H2,1H3,(H,17,18)(H,14,16,20)/p-1/b6-5+/t9-/m0/s1