2-[4-[2-methyl-3-(2-methylphenyl)phenoxy]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[2-methyl-3-(2-methylphenyl)phenoxy]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[2-methyl-3-(o-tolyl)phenoxy]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[2-methyl-3-(2-methylphenyl)phenoxy]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[2-methyl-3-(2-methylphenyl)phenoxy]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[2-methyl-3-(o-tolyl)phenoxy]butyl]isoindoline-1,3-quinone Formula: C26H25NO3 MolecularWeight: 399.4816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C(=CC=C2)OCCCCN3C(=O)C4=CC=CC=C4C3=O)C

Isomeric SMILES

CC1=CC=CC=C1C2=C(C(=CC=C2)OCCCCN3C(=O)C4=CC=CC=C4C3=O)C

InChI

InChI=1S/C26H25NO3/c1-18-10-3-4-11-20(18)21-14-9-15-24(19(21)2)30-17-8-7-16-27-25(28)22-12-5-6-13-23(22)26(27)29/h3-6,9-15H,7-8,16-17H2,1-2H3