[4-oxidanylidene-3-(phenylcarbonyl)-2-piperidin-1-yl-1-[(E)-prop-1-enyl]cyclobut-2-en-1-yl] ethanoate

Systemtic Name: [4-oxidanylidene-3-(phenylcarbonyl)-2-piperidin-1-yl-1-[(E)-prop-1-enyl]cyclobut-2-en-1-yl] ethanoate Openeye Name: [3-benzoyl-4-oxo-2-(1-piperidyl)-1-[(E)-prop-1-enyl]cyclobut-2-en-1-yl] acetate CAS Name: acetic acid [3-benzoyl-4-oxo-2-(1-piperidinyl)-1-[(E)-prop-1-enyl]-1-cyclobut-2-enyl] ester IUPAC Name: [3-benzoyl-4-oxo-2-piperidin-1-yl-1-[(E)-prop-1-enyl]cyclobut-2-en-1-yl] acetate Traditional Name: acetic acid [3-benzoyl-4-keto-2-piperidino-1-[(E)-prop-1-enyl]cyclobut-2-en-1-yl] ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1(C(=C(C1=O)C(=O)C2=CC=CC=C2)N3CCCCC3)OC(=O)C

Isomeric SMILES

C/C=C/C1(C(=C(C1=O)C(=O)C2=CC=CC=C2)N3CCCCC3)OC(=O)C

InChI

InChI=1S/C21H23NO4/c1-3-12-21(26-15(2)23)19(22-13-8-5-9-14-22)17(20(21)25)18(24)16-10-6-4-7-11-16/h3-4,6-7,10-12H,5,8-9,13-14H2,1-2H3/b12-3+