methyl 4-[[(3S)-3-(2-methoxy-2-oxidanylidene-ethyl)piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[(3S)-3-(2-methoxy-2-oxidanylidene-ethyl)piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[(3S)-3-(2-methoxy-2-oxo-ethyl)-1-piperidyl]methyl]benzoate CAS Name: 4-[[(3S)-3-(2-methoxy-2-oxoethyl)-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(3S)-3-(2-methoxy-2-oxoethyl)piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[(3S)-3-(2-keto-2-methoxy-ethyl)piperidino]methyl]benzoic acid methyl ester Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCCN(C1)CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COC(=O)C[C@@H]1CCCN(C1)CC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H23NO4/c1-21-16(19)10-14-4-3-9-18(12-14)11-13-5-7-15(8-6-13)17(20)22-2/h5-8,14H,3-4,9-12H2,1-2H3/t14-/m0/s1