(3S)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]piperidine-3-carboxylate

Systemtic Name: (3S)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]piperidine-3-carboxylate Openeye Name: (3S)-1-(3,5-dimethylisoxazole-4-carbonyl)piperidine-3-carboxylate CAS Name: (3S)-1-[(3,5-dimethyl-4-isoxazolyl)-oxomethyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(3,5-dimethylisoxazole-4-carbonyl)nipecotate Formula: C12H15N2O4- MolecularWeight: 251.2585

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)N2CCCC(C2)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)N2CCC[C@@H](C2)C(=O)[O-]

InChI

InChI=1S/C12H16N2O4/c1-7-10(8(2)18-13-7)11(15)14-5-3-4-9(6-14)12(16)17/h9H,3-6H2,1-2H3,(H,16,17)/p-1/t9-/m0/s1