2-[(3R,4S)-3-(2-diethylaminoethyl)-1-(2-phenylethanoyl)piperidin-4-yl]ethanoic acid

Systemtic Name: 2-[(3R,4S)-3-(2-diethylaminoethyl)-1-(2-phenylethanoyl)piperidin-4-yl]ethanoic acid Openeye Name: 2-[(3R,4S)-3-(2-diethylaminoethyl)-1-(2-phenylacetyl)-4-piperidyl]acetic acid CAS Name: 2-[(3R,4S)-3-(2-diethylaminoethyl)-1-(1-oxo-2-phenylethyl)-4-piperidinyl]acetic acid IUPAC Name: 2-[(3R,4S)-3-(2-diethylaminoethyl)-1-(2-phenylacetyl)piperidin-4-yl]acetic acid Traditional Name: 2-[(3R,4S)-3-(2-diethylaminoethyl)-1-(2-phenylacetyl)-4-piperidyl]acetic acid Formula: C21H32N2O3 MolecularWeight: 360.49038

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1CN(CCC1CC(=O)O)C(=O)CC2=CC=CC=C2

Isomeric SMILES

CCN(CC)CC[C@H]1CN(CC[C@H]1CC(=O)O)C(=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H32N2O3/c1-3-22(4-2)12-10-19-16-23(13-11-18(19)15-21(25)26)20(24)14-17-8-6-5-7-9-17/h5-9,18-19H,3-4,10-16H2,1-2H3,(H,25,26)/t18-,19-/m0/s1