ethyl (3S)-1-[[5-(methoxymethyl)furan-2-yl]methyl]-3-(2-phenoxyethyl)piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[[5-(methoxymethyl)furan-2-yl]methyl]-3-(2-phenoxyethyl)piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[[5-(methoxymethyl)-2-furyl]methyl]-3-(2-phenoxyethyl)piperidine-3-carboxylate CAS Name: (3S)-1-[[5-(methoxymethyl)-2-furanyl]methyl]-3-(2-phenoxyethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[[5-(methoxymethyl)furan-2-yl]methyl]-3-(2-phenoxyethyl)piperidine-3-carboxylate Traditional Name: (3S)-1-[[5-(methoxymethyl)-2-furyl]methyl]-3-(2-phenoxyethyl)nipecotic acid ethyl ester Formula: C23H31NO5 MolecularWeight: 401.49594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)CC2=CC=C(O2)COC)CCOC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@]1(CCCN(C1)CC2=CC=C(O2)COC)CCOC3=CC=CC=C3

InChI

InChI=1S/C23H31NO5/c1-3-27-22(25)23(13-15-28-19-8-5-4-6-9-19)12-7-14-24(18-23)16-20-10-11-21(29-20)17-26-2/h4-6,8-11H,3,7,12-18H2,1-2H3/t23-/m0/s1