[(3S,4S)-4-phenylpiperidin-3-yl] 4-(phenylcarbonyl)benzoate hydrochloride

Systemtic Name: [(3S,4S)-4-phenylpiperidin-3-yl] 4-(phenylcarbonyl)benzoate hydrochloride Openeye Name: [(3S,4S)-4-phenyl-3-piperidyl] 4-benzoylbenzoate hydrochloride CAS Name: 4-benzoylbenzoic acid [(3S,4S)-4-phenyl-3-piperidinyl] ester hydrochloride IUPAC Name: [(3S,4S)-4-phenylpiperidin-3-yl] 4-benzoylbenzoate hydrochloride Traditional Name: 4-benzoylbenzoic acid [(3S,4S)-4-phenyl-3-piperidyl] ester hydrochloride Formula: C25H24ClNO3 MolecularWeight: 421.91596

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C1C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4.Cl

Isomeric SMILES

C1CNC[C@H]([C@@H]1C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C25H23NO3.ClH/c27-24(19-9-5-2-6-10-19)20-11-13-21(14-12-20)25(28)29-23-17-26-16-15-22(23)18-7-3-1-4-8-18;/h1-14,22-23,26H,15-17H2;1H/t22-,23+;/m0./s1