methyl 4-benzamido-1-[(E)-but-2-enoyl]-2,2,6,6-tetramethyl-piperidine-4-carboxylate

Systemtic Name: methyl 4-benzamido-1-[(E)-but-2-enoyl]-2,2,6,6-tetramethyl-piperidine-4-carboxylate Openeye Name: methyl 4-benzamido-1-[(E)-but-2-enoyl]-2,2,6,6-tetramethyl-piperidine-4-carboxylate CAS Name: 4-benzamido-2,2,6,6-tetramethyl-1-[(E)-1-oxobut-2-enyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-benzamido-1-[(E)-but-2-enoyl]-2,2,6,6-tetramethylpiperidine-4-carboxylate Traditional Name: 4-benzamido-1-[(E)-but-2-enoyl]-2,2,6,6-tetramethyl-isonipecotic acid methyl ester Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1C(CC(CC1(C)C)(C(=O)OC)NC(=O)C2=CC=CC=C2)(C)C

Isomeric SMILES

C/C=C/C(=O)N1C(CC(CC1(C)C)(C(=O)OC)NC(=O)C2=CC=CC=C2)(C)C

InChI

InChI=1S/C22H30N2O4/c1-7-11-17(25)24-20(2,3)14-22(19(27)28-6,15-21(24,4)5)23-18(26)16-12-9-8-10-13-16/h7-13H,14-15H2,1-6H3,(H,23,26)/b11-7+