(3S)-1-(2-methyl-2-phenyl-propanoyl)piperidine-3-carboxylate

Systemtic Name: (3S)-1-(2-methyl-2-phenyl-propanoyl)piperidine-3-carboxylate Openeye Name: (3S)-1-(2-methyl-2-phenyl-propanoyl)piperidine-3-carboxylate CAS Name: (3S)-1-(2-methyl-1-oxo-2-phenylpropyl)-3-piperidinecarboxylate IUPAC Name: (3S)-1-(2-methyl-2-phenylpropanoyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(2-methyl-2-phenyl-propanoyl)nipecotate Formula: C16H20NO3- MolecularWeight: 274.3349

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(=O)N2CCCC(C2)C(=O)[O-]

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(=O)N2CCC[C@@H](C2)C(=O)[O-]

InChI

InChI=1S/C16H21NO3/c1-16(2,13-8-4-3-5-9-13)15(20)17-10-6-7-12(11-17)14(18)19/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,18,19)/p-1/t12-/m0/s1