methyl 4-[(3R)-3-(hydroxymethyl)-3-(phenylmethyl)piperidin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[(3R)-3-(hydroxymethyl)-3-(phenylmethyl)piperidin-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[(3R)-3-benzyl-3-(hydroxymethyl)-1-piperidyl]-4-oxo-butanoate CAS Name: 4-[(3R)-3-(hydroxymethyl)-3-(phenylmethyl)-1-piperidinyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[(3R)-3-benzyl-3-(hydroxymethyl)piperidin-1-yl]-4-oxobutanoate Traditional Name: 4-[(3R)-3-benzyl-3-methylol-piperidino]-4-keto-butyric acid methyl ester Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)N1CCCC(C1)(CC2=CC=CC=C2)CO

Isomeric SMILES

COC(=O)CCC(=O)N1CCC[C@](C1)(CC2=CC=CC=C2)CO

InChI

InChI=1S/C18H25NO4/c1-23-17(22)9-8-16(21)19-11-5-10-18(13-19,14-20)12-15-6-3-2-4-7-15/h2-4,6-7,20H,5,8-14H2,1H3/t18-/m1/s1