(3S)-1-(4-phenylbutanoyl)piperidine-3-carboxylate

Systemtic Name: (3S)-1-(4-phenylbutanoyl)piperidine-3-carboxylate Openeye Name: (3S)-1-(4-phenylbutanoyl)piperidine-3-carboxylate CAS Name: (3S)-1-(1-oxo-4-phenylbutyl)-3-piperidinecarboxylate IUPAC Name: (3S)-1-(4-phenylbutanoyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(4-phenylbutanoyl)nipecotate Formula: C16H20NO3- MolecularWeight: 274.3349

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCCC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CCCC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C16H21NO3/c18-15(10-4-8-13-6-2-1-3-7-13)17-11-5-9-14(12-17)16(19)20/h1-3,6-7,14H,4-5,8-12H2,(H,19,20)/p-1/t14-/m0/s1