bis(2-phenanthren-3-ylethyl) 3-methylpentanedioate

Systemtic Name: bis(2-phenanthren-3-ylethyl) 3-methylpentanedioate Openeye Name: bis[2-(3-phenanthryl)ethyl] 3-methylpentanedioate CAS Name: 3-methylpentanedioic acid bis[2-(3-phenanthrenyl)ethyl] ester IUPAC Name: bis(2-phenanthren-3-ylethyl) 3-methylpentanedioate Traditional Name: 3-methylglutaric acid bis[2-(3-phenanthryl)ethyl] ester Formula: C38H34O4 MolecularWeight: 554.67416

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCCC1=CC2=C(C=CC3=CC=CC=C32)C=C1)CC(=O)OCCC4=CC5=C(C=CC6=CC=CC=C65)C=C4

Isomeric SMILES

CC(CC(=O)OCCC1=CC2=C(C=CC3=CC=CC=C32)C=C1)CC(=O)OCCC4=CC5=C(C=CC6=CC=CC=C65)C=C4

InChI

InChI=1S/C38H34O4/c1-26(22-37(39)41-20-18-27-10-12-31-16-14-29-6-2-4-8-33(29)35(31)24-27)23-38(40)42-21-19-28-11-13-32-17-15-30-7-3-5-9-34(30)36(32)25-28/h2-17,24-26H,18-23H2,1H3