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

Systemtic Name: 2-[(3R,4S)-3-(2-diethylaminoethyl)-1-(phenylcarbonyl)piperidin-4-yl]ethanoic acid Openeye Name: 2-[(3R,4S)-1-benzoyl-3-(2-diethylaminoethyl)-4-piperidyl]acetic acid CAS Name: 2-[(3R,4S)-1-benzoyl-3-(2-diethylaminoethyl)-4-piperidinyl]acetic acid IUPAC Name: 2-[(3R,4S)-1-benzoyl-3-(2-diethylaminoethyl)piperidin-4-yl]acetic acid Traditional Name: 2-[(3R,4S)-1-benzoyl-3-(2-diethylaminoethyl)-4-piperidyl]acetic acid Formula: C20H30N2O3 MolecularWeight: 346.4638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O3/c1-3-21(4-2)12-10-18-15-22(13-11-17(18)14-19(23)24)20(25)16-8-6-5-7-9-16/h5-9,17-18H,3-4,10-15H2,1-2H3,(H,23,24)/t17-,18-/m0/s1