6-(9-hexylperylen-3-yl)hexyl N-prop-2-enylcarbamate

Systemtic Name: 6-(9-hexylperylen-3-yl)hexyl N-prop-2-enylcarbamate Openeye Name: 6-(9-hexylperylen-3-yl)hexyl N-allylcarbamate CAS Name: N-prop-2-enylcarbamic acid 6-(9-hexyl-3-perylenyl)hexyl ester IUPAC Name: 6-(9-hexylperylen-3-yl)hexyl N-prop-2-enylcarbamate Traditional Name: N-allylcarbamic acid 6-(9-hexylperylen-3-yl)hexyl ester Formula: C36H41NO2 MolecularWeight: 519.71624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C2C3=C4C(=CC=C3)C(=CC=C4C5=C2C1=CC=C5)CCCCCCOC(=O)NCC=C

Isomeric SMILES

CCCCCCC1=CC=C2C3=C4C(=CC=C3)C(=CC=C4C5=C2C1=CC=C5)CCCCCCOC(=O)NCC=C

InChI

InChI=1S/C36H41NO2/c1-3-5-6-9-14-26-20-22-32-31-19-13-17-29-27(15-10-7-8-11-25-39-36(38)37-24-4-2)21-23-33(35(29)31)30-18-12-16-28(26)34(30)32/h4,12-13,16-23H,2-3,5-11,14-15,24-25H2,1H3,(H,37,38)