ethyl 1-[(3,4-dimethylphenyl)carbamoyl]-4-[[(2R)-oxan-2-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(3,4-dimethylphenyl)carbamoyl]-4-[[(2R)-oxan-2-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(3,4-dimethylphenyl)carbamoyl]-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-4-carboxylate CAS Name: 1-[(3,4-dimethylanilino)-oxomethyl]-4-[[(2R)-2-oxanyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3,4-dimethylphenyl)carbamoyl]-4-[[(2R)-oxan-2-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[(3,4-dimethylphenyl)carbamoyl]-4-[[(2R)-tetrahydropyran-2-yl]methyl]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)NC2=CC(=C(C=C2)C)C)CC3CCCCO3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)NC2=CC(=C(C=C2)C)C)C[C@H]3CCCCO3

InChI

InChI=1S/C23H34N2O4/c1-4-28-21(26)23(16-20-7-5-6-14-29-20)10-12-25(13-11-23)22(27)24-19-9-8-17(2)18(3)15-19/h8-9,15,20H,4-7,10-14,16H2,1-3H3,(H,24,27)/t20-/m1/s1