methyl 4-(3-phenylmethoxy-4-thiophen-3-yl-1,2-oxazol-5-yl)piperidine-1-carboxylate

Systemtic Name: methyl 4-(3-phenylmethoxy-4-thiophen-3-yl-1,2-oxazol-5-yl)piperidine-1-carboxylate Openeye Name: methyl 4-[3-benzyloxy-4-(3-thienyl)isoxazol-5-yl]piperidine-1-carboxylate CAS Name: 4-[3-phenylmethoxy-4-(3-thiophenyl)-5-isoxazolyl]-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-phenylmethoxy-4-thiophen-3-yl-1,2-oxazol-5-yl)piperidine-1-carboxylate Traditional Name: 4-[3-benzoxy-4-(3-thienyl)isoxazol-5-yl]piperidine-1-carboxylic acid methyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC(CC1)C2=C(C(=NO2)OCC3=CC=CC=C3)C4=CSC=C4

Isomeric SMILES

COC(=O)N1CCC(CC1)C2=C(C(=NO2)OCC3=CC=CC=C3)C4=CSC=C4

InChI

InChI=1S/C21H22N2O4S/c1-25-21(24)23-10-7-16(8-11-23)19-18(17-9-12-28-14-17)20(22-27-19)26-13-15-5-3-2-4-6-15/h2-6,9,12,14,16H,7-8,10-11,13H2,1H3