ethyl 5-[3-(4-ethoxycarbonylpiperidin-1-yl)sulfonyl-4-methoxy-phenyl]-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 5-[3-(4-ethoxycarbonylpiperidin-1-yl)sulfonyl-4-methoxy-phenyl]-1,2-oxazole-3-carboxylate Openeye Name: ethyl 5-[3-[(4-ethoxycarbonyl-1-piperidyl)sulfonyl]-4-methoxy-phenyl]isoxazole-3-carboxylate CAS Name: 5-[3-[(4-ethoxycarbonyl-1-piperidinyl)sulfonyl]-4-methoxyphenyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(4-ethoxycarbonylpiperidin-1-yl)sulfonyl-4-methoxyphenyl]-1,2-oxazole-3-carboxylate Traditional Name: 5-[3-(4-carbethoxypiperidino)sulfonyl-4-methoxy-phenyl]isoxazole-3-carboxylic acid ethyl ester Formula: C21H26N2O8S MolecularWeight: 466.50474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C3=CC(=NO3)C(=O)OCC)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C3=CC(=NO3)C(=O)OCC)OC

InChI

InChI=1S/C21H26N2O8S/c1-4-29-20(24)14-8-10-23(11-9-14)32(26,27)19-12-15(6-7-17(19)28-3)18-13-16(22-31-18)21(25)30-5-2/h6-7,12-14H,4-5,8-11H2,1-3H3