ethyl 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-4-(2-phenoxyethyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-4-(2-phenoxyethyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(3,5-dimethylisoxazol-4-yl)sulfonyl-4-(2-phenoxyethyl)piperidine-4-carboxylate CAS Name: 1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-4-(2-phenoxyethyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-4-(2-phenoxyethyl)piperidine-4-carboxylate Traditional Name: 1-(3,5-dimethylisoxazol-4-yl)sulfonyl-4-(2-phenoxyethyl)isonipecotic acid ethyl ester Formula: C21H28N2O6S MolecularWeight: 436.52182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=C(ON=C2C)C)CCOC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=C(ON=C2C)C)CCOC3=CC=CC=C3

InChI

InChI=1S/C21H28N2O6S/c1-4-27-20(24)21(12-15-28-18-8-6-5-7-9-18)10-13-23(14-11-21)30(25,26)19-16(2)22-29-17(19)3/h5-9H,4,10-15H2,1-3H3