3-(octadecoxymethyl)perylene

Systemtic Name: 3-(octadecoxymethyl)perylene Openeye Name: 3-(octadecoxymethyl)perylene CAS Name: 3-(octadecoxymethyl)perylene IUPAC Name: 3-(octadecoxymethyl)perylene Traditional Name: 3-(stearyloxymethyl)perylene Formula: C39H50O MolecularWeight: 534.8137

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC1=CC=C2C3=CC=CC4=C3C(=CC=C4)C5=C2C1=CC=C5

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC1=CC=C2C3=CC=CC4=C3C(=CC=C4)C5=C2C1=CC=C5

InChI

InChI=1S/C39H50O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-29-40-30-32-27-28-37-35-25-19-22-31-21-18-24-34(38(31)35)36-26-20-23-33(32)39(36)37/h18-28H,2-17,29-30H2,1H3