methyl 4-[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[(3S)-3-[2-(4-methoxyphenyl)ethyl]-1-piperidyl]-4-oxo-butanoate CAS Name: 4-[(3S)-3-[2-(4-methoxyphenyl)ethyl]-1-piperidinyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidin-1-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidino]butyric acid methyl ester Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC2CCCN(C2)C(=O)CCC(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CC[C@H]2CCCN(C2)C(=O)CCC(=O)OC

InChI

InChI=1S/C19H27NO4/c1-23-17-9-7-15(8-10-17)5-6-16-4-3-13-20(14-16)18(21)11-12-19(22)24-2/h7-10,16H,3-6,11-14H2,1-2H3/t16-/m1/s1