1-[(E)-but-2-enoyl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[(E)-but-2-enoyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[(E)-but-2-enoyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[(E)-1-oxobut-2-enyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[(E)-but-2-enoyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[(E)-but-2-enoyl]-4-phenyl-isonipecotic acid Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

C/C=C/C(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H19NO3/c1-2-6-14(18)17-11-9-16(10-12-17,15(19)20)13-7-4-3-5-8-13/h2-8H,9-12H2,1H3,(H,19,20)/b6-2+