ethyl 4-(oxan-2-ylmethyl)-1-(phenethylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: ethyl 4-(oxan-2-ylmethyl)-1-(phenethylcarbamoyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(phenethylcarbamoyl)-4-(tetrahydropyran-2-ylmethyl)piperidine-4-carboxylate CAS Name: 4-(2-oxanylmethyl)-1-[oxo-(phenethylamino)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(oxan-2-ylmethyl)-1-(phenethylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenethylcarbamoyl)-4-(tetrahydropyran-2-ylmethyl)isonipecotic acid ethyl ester Formula: C23H34N2O4 MolecularWeight: 402.52706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)NCCC2=CC=CC=C2)CC3CCCCO3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)NCCC2=CC=CC=C2)CC3CCCCO3

InChI

InChI=1S/C23H34N2O4/c1-2-28-21(26)23(18-20-10-6-7-17-29-20)12-15-25(16-13-23)22(27)24-14-11-19-8-4-3-5-9-19/h3-5,8-9,20H,2,6-7,10-18H2,1H3,(H,24,27)