(3-methyl-3-bicyclo[2.2.1]heptanyl) 2-pyren-1-ylethanoate

Systemtic Name: (3-methyl-3-bicyclo[2.2.1]heptanyl) 2-pyren-1-ylethanoate Openeye Name: (2-methylnorbornan-2-yl) 2-pyren-1-ylacetate CAS Name: 2-(1-pyrenyl)acetic acid (3-methyl-3-bicyclo[2.2.1]heptanyl) ester IUPAC Name: (3-methyl-3-bicyclo[2.2.1]heptanyl) 2-pyren-1-ylacetate Traditional Name: 2-pyren-1-ylacetic acid (2-methylnorbornan-2-yl) ester Formula: C26H24O2 MolecularWeight: 368.46756

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2CCC1C2)OC(=O)CC3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3

Isomeric SMILES

CC1(CC2CCC1C2)OC(=O)CC3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3

InChI

InChI=1S/C26H24O2/c1-26(15-16-5-11-21(26)13-16)28-23(27)14-20-9-8-19-7-6-17-3-2-4-18-10-12-22(20)25(19)24(17)18/h2-4,6-10,12,16,21H,5,11,13-15H2,1H3