(E)-4-[[(3S,5S)-3,5-dimethylpiperidin-1-yl]carbonylamino]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[[(3S,5S)-3,5-dimethylpiperidin-1-yl]carbonylamino]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]amino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[[(3S,5S)-3,5-dimethyl-1-piperidinyl]-oxomethyl]amino]-4-oxo-2-butenoate IUPAC Name: (E)-4-[[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]amino]-4-oxobut-2-enoate Traditional Name: (E)-4-[[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]amino]-4-keto-but-2-enoate Formula: C12H17N2O4- MolecularWeight: 253.27438

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)NC(=O)C=CC(=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O4/c1-8-5-9(2)7-14(6-8)12(18)13-10(15)3-4-11(16)17/h3-4,8-9H,5-7H2,1-2H3,(H,16,17)(H,13,15,18)/p-1/b4-3+/t8-,9-/m0/s1