ethanedioic acid; ethyl 4-(2-phenoxyphenyl)piperidine-4-carboxylate

Systemtic Name: ethanedioic acid; ethyl 4-(2-phenoxyphenyl)piperidine-4-carboxylate Openeye Name: ethyl 4-(2-phenoxyphenyl)piperidine-4-carboxylate; oxalic acid CAS Name: oxalic acid; 4-(2-phenoxyphenyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-phenoxyphenyl)piperidine-4-carboxylate; oxalic acid Traditional Name: oxalic acid; 4-(2-phenoxyphenyl)isonipecotic acid ethyl ester Formula: C22H25NO7 MolecularWeight: 415.4364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCNCC1)C2=CC=CC=C2OC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)C1(CCNCC1)C2=CC=CC=C2OC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H23NO3.C2H2O4/c1-2-23-19(22)20(12-14-21-15-13-20)17-10-6-7-11-18(17)24-16-8-4-3-5-9-16;3-1(4)2(5)6/h3-11,21H,2,12-15H2,1H3;(H,3,4)(H,5,6)