(phenylmethyl) 4-[(E)-3-(cyclohexen-1-yl)prop-2-enoyl]oxypent-2-ynoate

Systemtic Name: (phenylmethyl) 4-[(E)-3-(cyclohexen-1-yl)prop-2-enoyl]oxypent-2-ynoate Openeye Name: benzyl 4-[(E)-3-(cyclohexen-1-yl)prop-2-enoyl]oxypent-2-ynoate CAS Name: 4-[(E)-3-(1-cyclohexenyl)-1-oxoprop-2-enoxy]-2-pentynoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[(E)-3-(cyclohexen-1-yl)prop-2-enoyl]oxypent-2-ynoate Traditional Name: 4-[(E)-3-(cyclohexen-1-yl)acryloyl]oxypent-2-ynoic acid benzyl ester Formula: C21H22O4 MolecularWeight: 338.39698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC(=O)OCC1=CC=CC=C1)OC(=O)C=CC2=CCCCC2

Isomeric SMILES

CC(C#CC(=O)OCC1=CC=CC=C1)OC(=O)/C=C/C2=CCCCC2

InChI

InChI=1S/C21H22O4/c1-17(25-21(23)15-13-18-8-4-2-5-9-18)12-14-20(22)24-16-19-10-6-3-7-11-19/h3,6-8,10-11,13,15,17H,2,4-5,9,16H2,1H3/b15-13+