prop-2-enyl 1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-3-phenyl-piperidine-2-carboxylate

Systemtic Name: prop-2-enyl 1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-3-phenyl-piperidine-2-carboxylate Openeye Name: allyl 1-(3,3-dimethyl-2-oxo-pentanoyl)-3-phenyl-piperidine-2-carboxylate CAS Name: 1-(3,3-dimethyl-1,2-dioxopentyl)-3-phenyl-2-piperidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 1-(3,3-dimethyl-2-oxopentanoyl)-3-phenylpiperidine-2-carboxylate Traditional Name: 1-(2-keto-3,3-dimethyl-pentanoyl)-3-phenyl-pipecolinic acid allyl ester Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1CCCC(C1C(=O)OCC=C)C2=CC=CC=C2

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1CCCC(C1C(=O)OCC=C)C2=CC=CC=C2

InChI

InChI=1S/C22H29NO4/c1-5-15-27-21(26)18-17(16-11-8-7-9-12-16)13-10-14-23(18)20(25)19(24)22(3,4)6-2/h5,7-9,11-12,17-18H,1,6,10,13-15H2,2-4H3