tert-butyl 4-[(E)-3-(2,6-dimethylphenyl)prop-2-enoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(E)-3-(2,6-dimethylphenyl)prop-2-enoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(E)-3-(2,6-dimethylphenyl)prop-2-enoyl]piperidine-1-carboxylate CAS Name: 4-[(E)-3-(2,6-dimethylphenyl)-1-oxoprop-2-enyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(E)-3-(2,6-dimethylphenyl)prop-2-enoyl]piperidine-1-carboxylate Traditional Name: 4-[(E)-3-(2,6-dimethylphenyl)acryloyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO3/c1-15-7-6-8-16(2)18(15)9-10-19(23)17-11-13-22(14-12-17)20(24)25-21(3,4)5/h6-10,17H,11-14H2,1-5H3/b10-9+