ethyl 4-[[5-[(2,6-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[5-[(2,6-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[5-[(2,6-dimethylphenoxy)methyl]isoxazole-3-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[5-[(2,6-dimethylphenoxy)methyl]-3-isoxazolyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[5-[(2,6-dimethylphenoxy)methyl]-1,2-oxazole-3-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[5-[(2,6-dimethylphenoxy)methyl]isoxazole-3-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=NOC(=C2)COC3=C(C=CC=C3C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=NOC(=C2)COC3=C(C=CC=C3C)C

InChI

InChI=1S/C21H27N3O5/c1-4-27-21(26)24-10-8-16(9-11-24)22-20(25)18-12-17(29-23-18)13-28-19-14(2)6-5-7-15(19)3/h5-7,12,16H,4,8-11,13H2,1-3H3,(H,22,25)