tert-butyl 4-[(E)-4-(2,6-dimethylphenyl)but-3-en-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(E)-4-(2,6-dimethylphenyl)but-3-en-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(E)-3-(2,6-dimethylphenyl)-1-methyl-allyl]piperidine-1-carboxylate CAS Name: 4-[(E)-4-(2,6-dimethylphenyl)but-3-en-2-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(E)-4-(2,6-dimethylphenyl)but-3-en-2-yl]piperidine-1-carboxylate Traditional Name: 4-[(E)-3-(2,6-dimethylphenyl)-1-methyl-allyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H33NO2 MolecularWeight: 343.50292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C=CC(C)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)/C=C/C(C)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H33NO2/c1-16(10-11-20-17(2)8-7-9-18(20)3)19-12-14-23(15-13-19)21(24)25-22(4,5)6/h7-11,16,19H,12-15H2,1-6H3/b11-10+